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ULG

ULG
Name:	(1R)-4-(3,5-difluorophenoxy)-7-(trifluoromethyl)-2,3-dihydro-1H-inden-1-ol
Formula:	C16 H11 F5 O2
SMILES:	FC(F)(F)c1ccc(c2c1C(O)CC2)Oc3cc(F)cc(c3)F
InChi:	InChI=1S/C16H11F5O2/c17-8-5-9(18)7-10(6-8)23-14-4-2-12(16(19,20)21)15-11(14)1-3-13(15)22/h2,4-7,13,22H,1,3H2/t13-/m1/s1
Definition date:	2020-05-21
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	(1R)-4-(3,5-difluorophenoxy)-7-(trifluoromethyl)-2,3-dihydro-1H-inden-1-ol

ULM

ULM
Name:	(6R,7S)-4-[(3,3-difluorocyclobutyl)oxy]-6-fluoro-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-7-ol
Formula:	C13 H11 F6 N O2
SMILES:	c1(cnc(c2c1CC(C2O)F)C(F)(F)F)OC3CC(C3)(F)F
InChi:	InChI=1S/C13H11F6NO2/c14-7-1-6-8(22-5-2-12(15,16)3-5)4-20-11(13(17,18)19)9(6)10(7)21/h4-5,7,10,21H,1-3H2/t7-,10-/m1/s1
Definition date:	2020-05-22
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	(6R,7S)-4-[(3,3-difluorocyclobutyl)oxy]-6-fluoro-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-7-ol

ULS

ULS
Name:	3-fluoro-5-{[(7R)-7-hydroxy-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-4-yl]oxy}benzonitrile
Formula:	C16 H10 F4 N2 O2
SMILES:	N#Cc1cc(cc(c1)Oc2cnc(c3c2CCC3O)C(F)(F)F)F
InChi:	InChI=1S/C16H10F4N2O2/c17-9-3-8(6-21)4-10(5-9)24-13-7-22-15(16(18,19)20)14-11(13)1-2-12(14)23/h3-5,7,12,23H,1-2H2/t12-/m1/s1
Definition date:	2020-05-22
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	3-fluoro-5-{[(7R)-7-hydroxy-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-4-yl]oxy}benzonitrile

ZG7

ZG7
Name:	(8S)-6-(3-bromophenoxy)-2-[1-(4-chlorophenyl)cyclopropyl]-7-hydroxypyrazolo[1,5-a]pyrimidine-3-carbonitrile
Formula:	C22 H14 Br Cl N4 O2
SMILES:	Clc1ccc(cc1)C1(CC1)c1nn2c(O)c(cnc2c1C#N)Oc1cccc(Br)c1
InChi:	InChI=1S/C22H14BrClN4O2/c23-14-2-1-3-16(10-14)30-18-12-26-20-17(11-25)19(27-28(20)21(18)29)22(8-9-22)13-4-6-15(24)7-5-13/h1-7,10,12,29H,8-9H2
Definition date:	2021-04-19
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	(8S)-6-(3-bromophenoxy)-2-[1-(4-chlorophenyl)cyclopropyl]-7-hydroxypyrazolo[1,5-a]pyrimidine-3-carbonitrile

ZXX

ZXX
Name:	methyl (3~{S})-1-[(2~{S})-2-[[(2~{S})-2-acetamido-3-methyl-butanoyl]amino]-3-(3-hydroxyphenyl)propanoyl]-1,2-diazinane-3-carboxylate
Formula:	C22 H32 N4 O6
SMILES:	O=C(N1CCCC(N1)C(=O)OC)C(Cc1cccc(O)c1)NC(=O)C(NC(C)=O)C(C)C
InChi:	InChI=1S/C22H32N4O6/c1-13(2)19(23-14(3)27)20(29)24-18(12-15-7-5-8-16(28)11-15)21(30)26-10-6-9-17(25-26)22(31)32-4/h5,7-8,11,13,17-19,25,28H,6,9-10,12H2,1-4H3,(H,23,27)(H,24,29)/t17-,18-,19-/m0/s1
Definition date:	2020-05-22
Last modified:	2021-05-21
Release date:	2020-06-24
Identifier:	methyl (3S)-1-(N-acetyl-L-valyl-3-hydroxy-L-phenylalanyl)-1,2-diazinane-3-carboxylate

T2Q

T2Q
Name:	1-[[3-(4-methylsulfonylpiperidin-1-yl)phenyl]methyl]-5-[3-[4-(trifluoromethyloxy)phenyl]-1,2,4-oxadiazol-5-yl]pyridin-2-one
Formula:	C27 H25 F3 N4 O5 S
SMILES:	C[S](=O)(=O)C1CCN(CC1)c2cccc(CN3C=C(C=CC3=O)c4onc(n4)c5ccc(OC(F)(F)F)cc5)c2
InChi:	InChI=1S/C27H25F3N4O5S/c1-40(36,37)23-11-13-33(14-12-23)21-4-2-3-18(15-21)16-34-17-20(7-10-24(34)35)26-31-25(32-39-26)19-5-8-22(9-6-19)38-27(28,29)30/h2-10,15,17,23H,11-14,16H2,1H3
Definition date:	2020-12-14
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	1-[[3-(4-methylsulfonylpiperidin-1-yl)phenyl]methyl]-5-[3-[4-(trifluoromethyloxy)phenyl]-1,2,4-oxadiazol-5-yl]pyridin-2-one

Q9H

Q9H
Name:	(2~{R},3~{R},4~{S},5~{R})-2-[6-azanyl-8-[3-[[(2~{R},3~{S},4~{R},5~{R})-5-[6-(2-azanylethylamino)purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]prop-1-ynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Formula:	C25 H31 N11 O8
SMILES:	NCCNc1ncnc2n(cnc12)[CH]3O[CH](COCC#Cc4nc5c(N)ncnc5n4[CH]6O[CH](CO)[CH](O)[CH]6O)[CH](O)[CH]3O
InChi:	InChI=1S/C25H31N11O8/c26-3-4-28-21-15-22(31-9-30-21)35(10-33-15)24-18(40)17(39)12(44-24)7-42-5-1-2-13-34-14-20(27)29-8-32-23(14)36(13)25-19(41)16(38)11(6-37)43-25/h8-12,16-19,24-25,37-41H,3-7,26H2,(H2,27,29,32)(H,28,30,31)/t11-,12-,16-,17-,18-,19-,24-,25-/m1/s1
Definition date:	2020-05-28
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	(2~{R},3~{R},4~{S},5~{R})-2-[6-azanyl-8-[3-[[(2~{R},3~{S},4~{R},5~{R})-5-[6-(2-azanylethylamino)purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]prop-1-ynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Q9K

Q9K
Name:	(2~{R},3~{R},4~{S},5~{R})-2-(6-aminopurin-9-yl)-5-[[3-[6-azanyl-9-[(2~{R},3~{R},4~{S},5~{R})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-8-yl]prop-2-ynyl-(3-azanylpropyl)amino]methyl]oxolane-3,4-diol
Formula:	C26 H34 N12 O7
SMILES:	NCCCN(CC#Cc1nc2c(N)ncnc2n1[CH]3O[CH](CO)[CH](O)[CH]3O)C[CH]4O[CH]([CH](O)[CH]4O)n5cnc6c(N)ncnc56
InChi:	InChI=1S/C26H34N12O7/c27-4-2-6-36(7-12-17(40)19(42)25(44-12)37-11-34-15-21(28)30-9-32-23(15)37)5-1-3-14-35-16-22(29)31-10-33-24(16)38(14)26-20(43)18(41)13(8-39)45-26/h9-13,17-20,25-26,39-43H,2,4-8,27H2,(H2,28,30,32)(H2,29,31,33)/t12-,13-,17-,18-,19-,20-,25-,26-/m1/s1
Definition date:	2020-05-28
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	(2~{R},3~{R},4~{S},5~{R})-2-(6-aminopurin-9-yl)-5-[[3-[6-azanyl-9-[(2~{R},3~{R},4~{S},5~{R})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-8-yl]prop-2-ynyl-(3-azanylpropyl)amino]methyl]oxolane-3,4-diol

Q9N

Q9N
Name:	~{N}-[[(2~{R},3~{S},4~{R},5~{R})-5-[8-[3-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]prop-1-ynyl]-6-azanyl-purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-4-azanyl-butanamide
Formula:	C27 H34 N12 O8
SMILES:	NCCCC(=O)NC[CH]1O[CH]([CH](O)[CH]1O)n2c(nc3c(N)ncnc23)C#CCOC[CH]4O[CH]([CH](O)[CH]4O)n5cnc6c(N)ncnc56
InChi:	InChI=1S/C27H34N12O8/c28-5-1-4-15(40)31-7-12-18(41)21(44)27(46-12)39-14(37-17-23(30)33-10-35-25(17)39)3-2-6-45-8-13-19(42)20(43)26(47-13)38-11-36-16-22(29)32-9-34-24(16)38/h9-13,18-21,26-27,41-44H,1,4-8,28H2,(H,31,40)(H2,29,32,34)(H2,30,33,35)/t12-,13-,18-,19-,20-,21-,26-,27-/m1/s1
Definition date:	2020-05-28
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	~{N}-[[(2~{R},3~{S},4~{R},5~{R})-5-[8-[3-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]prop-1-ynyl]-6-azanyl-purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-4-azanyl-butanamide

V5J

V5J
Name:	3-(2-cyanopropan-2-yl)-N-[2-fluoro-4-methyl-5-(7-methyl-8-oxo-7,8-dihydropyrido[2,3-d]pyridazin-3-yl)phenyl]benzamide
Formula:	C26 H22 F N5 O2
SMILES:	c2(F)c(NC(c1cccc(c1)C(C)(C)C#N)=O)cc(c(C)c2)c3cnc4c(c3)C=NN(C4=O)C
InChi:	InChI=1S/C26H22FN5O2/c1-15-8-21(27)22(31-24(33)16-6-5-7-19(10-16)26(2,3)14-28)11-20(15)17-9-18-13-30-32(4)25(34)23(18)29-12-17/h5-13H,1-4H3,(H,31,33)
Definition date:	2020-06-29
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	3-(2-cyanopropan-2-yl)-N-[2-fluoro-4-methyl-5-(7-methyl-8-oxo-7,8-dihydropyrido[2,3-d]pyridazin-3-yl)phenyl]benzamide

RHH

RHH
Name:	4-[2-methyl-3-(2-pyridin-2-yloxyethyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
Formula:	C19 H19 N7 O
SMILES:	Cc1nc2ccc(nc2n1CCOc3ccccn3)c4cc(N)nc(N)c4
InChi:	InChI=1S/C19H19N7O/c1-12-23-15-6-5-14(13-10-16(20)25-17(21)11-13)24-19(15)26(12)8-9-27-18-4-2-3-7-22-18/h2-7,10-11H,8-9H2,1H3,(H4,20,21,25)
Definition date:	2020-09-29
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-[2-methyl-3-(2-pyridin-2-yloxyethyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine

RHT

RHT
Name:	4-(3-methylbenzimidazol-5-yl)pyridine-2,6-diamine
Formula:	C13 H13 N5
SMILES:	Cn1cnc2ccc(cc12)c3cc(N)nc(N)c3
InChi:	InChI=1S/C13H13N5/c1-18-7-16-10-3-2-8(4-11(10)18)9-5-12(14)17-13(15)6-9/h2-7H,1H3,(H4,14,15,17)
Definition date:	2020-09-30
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-(3-methylbenzimidazol-5-yl)pyridine-2,6-diamine

RHW

RHW
Name:	4-(1-benzofuran-5-yl)pyridine-2,6-diamine
Formula:	C13 H11 N3 O
SMILES:	Nc1cc(cc(N)n1)c2ccc3occc3c2
InChi:	InChI=1S/C13H11N3O/c14-12-6-10(7-13(15)16-12)8-1-2-11-9(5-8)3-4-17-11/h1-7H,(H4,14,15,16)
Definition date:	2020-09-30
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-(1-benzofuran-5-yl)pyridine-2,6-diamine

RHZ

RHZ
Name:	4-(4-chloranyl-3-methoxy-phenyl)pyridin-2-amine
Formula:	C12 H11 Cl N2 O
SMILES:	COc1cc(ccc1Cl)c2ccnc(N)c2
InChi:	InChI=1S/C12H11ClN2O/c1-16-11-6-8(2-3-10(11)13)9-4-5-15-12(14)7-9/h2-7H,1H3,(H2,14,15)
Definition date:	2020-09-30
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-(4-chloranyl-3-methoxy-phenyl)pyridin-2-amine

RJ2

RJ2
Name:	1-[4-(1-benzofuran-5-yl)pyridin-2-yl]piperazine
Formula:	C17 H17 N3 O
SMILES:	C1CN(CCN1)c2cc(ccn2)c3ccc4occc4c3
InChi:	InChI=1S/C17H17N3O/c1-2-16-15(4-10-21-16)11-13(1)14-3-5-19-17(12-14)20-8-6-18-7-9-20/h1-5,10-12,18H,6-9H2
Definition date:	2020-09-30
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	1-[4-(1-benzofuran-5-yl)pyridin-2-yl]piperazine

RJ5

RJ5
Name:	4-(4-methoxyphenyl)pyridin-2-amine
Formula:	C12 H12 N2 O
SMILES:	COc1ccc(cc1)c2ccnc(N)c2
InChi:	InChI=1S/C12H12N2O/c1-15-11-4-2-9(3-5-11)10-6-7-14-12(13)8-10/h2-8H,1H3,(H2,13,14)
Definition date:	2020-09-30
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-(4-methoxyphenyl)pyridin-2-amine

RJ8

RJ8
Name:	4-(1-benzofuran-5-yl)pyridin-2-amine
Formula:	C13 H10 N2 O
SMILES:	Nc1cc(ccn1)c2ccc3occc3c2
InChi:	InChI=1S/C13H10N2O/c14-13-8-10(3-5-15-13)9-1-2-12-11(7-9)4-6-16-12/h1-8H,(H2,14,15)
Definition date:	2020-09-30
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-(1-benzofuran-5-yl)pyridin-2-amine

RJZ

RJZ
Name:	4-[3-[2-(6-bromanylpyridin-2-yl)oxyethyl]-2-methyl-imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
Formula:	C19 H18 Br N7 O
SMILES:	Cc1nc2ccc(nc2n1CCOc3cccc(Br)n3)c4cc(N)nc(N)c4
InChi:	InChI=1S/C19H18BrN7O/c1-11-23-14-6-5-13(12-9-16(21)26-17(22)10-12)24-19(14)27(11)7-8-28-18-4-2-3-15(20)25-18/h2-6,9-10H,7-8H2,1H3,(H4,21,22,26)
Definition date:	2020-09-30
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-[3-[2-(6-bromanylpyridin-2-yl)oxyethyl]-2-methyl-imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine

RK2

RK2
Name:	4-[2-methyl-3-[(2~{R})-2-pyridin-2-yloxypropyl]imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
Formula:	C20 H21 N7 O
SMILES:	C[CH](Cn1c(C)nc2ccc(nc12)c3cc(N)nc(N)c3)Oc4ccccn4
InChi:	InChI=1S/C20H21N7O/c1-12(28-19-5-3-4-8-23-19)11-27-13(2)24-16-7-6-15(25-20(16)27)14-9-17(21)26-18(22)10-14/h3-10,12H,11H2,1-2H3,(H4,21,22,26)/t12-/m1/s1
Definition date:	2020-09-30
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-[2-methyl-3-[(2~{R})-2-pyridin-2-yloxypropyl]imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine

RK5

RK5
Name:	4-(2,3-dimethyl-1-benzofuran-5-yl)pyridine-2,6-diamine
Formula:	C15 H15 N3 O
SMILES:	Cc1oc2ccc(cc2c1C)c3cc(N)nc(N)c3
InChi:	InChI=1S/C15H15N3O/c1-8-9(2)19-13-4-3-10(5-12(8)13)11-6-14(16)18-15(17)7-11/h3-7H,1-2H3,(H4,16,17,18)
Definition date:	2020-09-30
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-(2,3-dimethyl-1-benzofuran-5-yl)pyridine-2,6-diamine

RK8

RK8
Name:	4-[3-[(2~{S})-2-(6-bromanylpyridin-2-yl)oxypropyl]-2-methyl-imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
Formula:	C20 H20 Br N7 O
SMILES:	C[CH](Cn1c(C)nc2ccc(nc12)c3cc(N)nc(N)c3)Oc4cccc(Br)n4
InChi:	InChI=1S/C20H20BrN7O/c1-11(29-19-5-3-4-16(21)26-19)10-28-12(2)24-15-7-6-14(25-20(15)28)13-8-17(22)27-18(23)9-13/h3-9,11H,10H2,1-2H3,(H4,22,23,27)/t11-/m0/s1
Definition date:	2020-09-30
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-[3-[(2~{S})-2-(6-bromanylpyridin-2-yl)oxypropyl]-2-methyl-imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine

RKH

RKH
Name:	4-(2-methyl-1-benzofuran-5-yl)pyridine-2,6-diamine
Formula:	C14 H13 N3 O
SMILES:	Cc1oc2ccc(cc2c1)c3cc(N)nc(N)c3
InChi:	InChI=1S/C14H13N3O/c1-8-4-11-5-9(2-3-12(11)18-8)10-6-13(15)17-14(16)7-10/h2-7H,1H3,(H4,15,16,17)
Definition date:	2020-10-01
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-(2-methyl-1-benzofuran-5-yl)pyridine-2,6-diamine

RKK

RKK
Name:	4-(2,3-dibutylimidazo[4,5-b]pyridin-5-yl)pyridine-2,6-diamine
Formula:	C19 H26 N6
SMILES:	CCCCn1c(CCCC)nc2ccc(nc12)c3cc(N)nc(N)c3
InChi:	InChI=1S/C19H26N6/c1-3-5-7-18-22-15-9-8-14(13-11-16(20)24-17(21)12-13)23-19(15)25(18)10-6-4-2/h8-9,11-12H,3-7,10H2,1-2H3,(H4,20,21,24)
Synonyms:	4-{2,3-dibutyl-3H-imidazo[4,5-b]pyridin-5-yl}pyridine-2,6-diamine
Definition date:	2020-10-01
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-(2,3-dibutylimidazo[4,5-b]pyridin-5-yl)pyridine-2,6-diamine

RKQ

RKQ
Name:	4-[2-methyl-3-(2-phenoxyethyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
Formula:	C20 H20 N6 O
SMILES:	Cc1nc2ccc(nc2n1CCOc3ccccc3)c4cc(N)nc(N)c4
InChi:	InChI=1S/C20H20N6O/c1-13-23-17-8-7-16(14-11-18(21)25-19(22)12-14)24-20(17)26(13)9-10-27-15-5-3-2-4-6-15/h2-8,11-12H,9-10H2,1H3,(H4,21,22,25)
Definition date:	2020-10-01
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	4-[2-methyl-3-(2-phenoxyethyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine

RKW

RKW
Name:	~{N}-[6-azanyl-4-(1-benzofuran-5-yl)pyridin-2-yl]-2-(methylamino)ethanamide
Formula:	C16 H16 N4 O2
SMILES:	CNCC(=O)Nc1cc(cc(N)n1)c2ccc3occc3c2
InChi:	InChI=1S/C16H16N4O2/c1-18-9-16(21)20-15-8-12(7-14(17)19-15)10-2-3-13-11(6-10)4-5-22-13/h2-8,18H,9H2,1H3,(H3,17,19,20,21)
Definition date:	2020-10-01
Last modified:	2021-05-21
Release date:	2021-05-26
Identifier:	~{N}-[6-azanyl-4-(1-benzofuran-5-yl)pyridin-2-yl]-2-(methylamino)ethanamide

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