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4RP

4RP
Name:	N-(3,5-dichlorobenzyl)-N'-(1H-imidazo[4,5-b]pyridin-2-yl)propane-1,3-diamine
Formula:	C16 H17 Cl2 N5
SMILES:	c3c(Cl)cc(CNCCCNc1nc2c(n1)nccc2)cc3Cl
InChi:	InChI=1S/C16H17Cl2N5/c17-12-7-11(8-13(18)9-12)10-19-4-2-6-21-16-22-14-3-1-5-20-15(14)23-16/h1,3,5,7-9,19H,2,4,6,10H2,(H2,20,21,22,23)
Definition date:	2015-05-15
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	N-(3,5-dichlorobenzyl)-N'-(1H-imidazo[4,5-b]pyridin-2-yl)propane-1,3-diamine

4RQ

4RQ
Name:	N-(3,5-dichlorobenzyl)-N'-(5-fluoro-1H-imidazo[4,5-b]pyridin-2-yl)propane-1,3-diamine
Formula:	C16 H16 Cl2 F N5
SMILES:	N(CCCNCc1cc(cc(Cl)c1)Cl)c2nc3c(n2)nc(F)cc3
InChi:	InChI=1S/C16H16Cl2FN5/c17-11-6-10(7-12(18)8-11)9-20-4-1-5-21-16-22-13-2-3-14(19)23-15(13)24-16/h2-3,6-8,20H,1,4-5,9H2,(H2,21,22,23,24)
Definition date:	2015-05-15
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	N-(3,5-dichlorobenzyl)-N'-(5-fluoro-1H-imidazo[4,5-b]pyridin-2-yl)propane-1,3-diamine

4WE

4WE
Name:	4-({5-fluoro-4-[2-methyl-1-(propan-2-yl)-1H-imidazol-5-yl]pyrimidin-2-yl}amino)-N-[2-(piperidin-1-yl)ethyl]benzamide
Formula:	C25 H32 F N7 O
SMILES:	CC(C)n1c(C)ncc1c4c(cnc(Nc3ccc(C(NCCN2CCCCC2)=O)cc3)n4)F
InChi:	InChI=1S/C25H32FN7O/c1-17(2)33-18(3)28-16-22(33)23-21(26)15-29-25(31-23)30-20-9-7-19(8-10-20)24(34)27-11-14-32-12-5-4-6-13-32/h7-10,15-17H,4-6,11-14H2,1-3H3,(H,27,34)(H,29,30,31)
Definition date:	2015-06-11
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4-({5-fluoro-4-[2-methyl-1-(propan-2-yl)-1H-imidazol-5-yl]pyrimidin-2-yl}amino)-N-[2-(piperidin-1-yl)ethyl]benzamide

4WG

4WG
Name:	2-{[2-ethoxy-4-(4-hydroxypiperidin-1-yl)phenyl]amino}-5,11-dimethyl-5,11-dihydro-6H-pyrimido[4,5-b][1,4]benzodiazepin-6-one
Formula:	C26 H30 N6 O3
SMILES:	C(Oc1c(ccc(c1)N2CCC(O)CC2)Nc5nc4N(c3ccccc3C(=O)N(C)c4cn5)C)C
InChi:	InChI=1S/C26H30N6O3/c1-4-35-23-15-17(32-13-11-18(33)12-14-32)9-10-20(23)28-26-27-16-22-24(29-26)30(2)21-8-6-5-7-19(21)25(34)31(22)3/h5-10,15-16,18,33H,4,11-14H2,1-3H3,(H,27,28,29)
Definition date:	2015-06-11
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	2-{[2-ethoxy-4-(4-hydroxypiperidin-1-yl)phenyl]amino}-5,11-dimethyl-5,11-dihydro-6H-pyrimido[4,5-b][1,4]benzodiazepin-6-one

5ES

5ES
Name:	4,4'-(2-{3-[(4-fluorophenyl)amino]phenyl}ethene-1,1-diyl)diphenol
Formula:	C26 H20 F N O2
SMILES:	Oc1ccc(cc1)/C(c2ccc(O)cc2)=C/c3cc(ccc3)Nc4ccc(cc4)F
InChi:	InChI=1S/C26H20FNO2/c27-21-8-10-22(11-9-21)28-23-3-1-2-18(16-23)17-26(19-4-12-24(29)13-5-19)20-6-14-25(30)15-7-20/h1-17,28-30H
Definition date:	2015-09-17
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-(2-{3-[(4-fluorophenyl)amino]phenyl}ethene-1,1-diyl)diphenol

5ET

5ET
Name:	4,4'-thiene-2,5-diylbis(3-chlorophenol)
Formula:	C16 H10 Cl2 O2 S
SMILES:	c1(cc(c(cc1)c3sc(c2c(cc(cc2)O)Cl)cc3)Cl)O
InChi:	InChI=1S/C16H10Cl2O2S/c17-13-7-9(19)1-3-11(13)15-5-6-16(21-15)12-4-2-10(20)8-14(12)18/h1-8,19-20H
Definition date:	2015-09-17
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-thiene-2,5-diylbis(3-chlorophenol)

5EU

5EU
Name:	4,4'-(3-methylthiene-2,5-diyl)bis(3-chlorophenol)
Formula:	C17 H12 Cl2 O2 S
SMILES:	Oc3ccc(c2cc(c(c1c(cc(cc1)O)Cl)s2)C)c(Cl)c3
InChi:	InChI=1S/C17H12Cl2O2S/c1-9-6-16(12-4-2-10(20)7-14(12)18)22-17(9)13-5-3-11(21)8-15(13)19/h2-8,20-21H,1H3
Definition date:	2015-09-17
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-(3-methylthiene-2,5-diyl)bis(3-chlorophenol)

5FS

5FS
Name:	3,4-bis(4-hydroxy-2-methylphenyl)-1H-1lambda~6~-thiophene-1,1-dione
Formula:	C18 H16 O4 S
SMILES:	Oc3cc(c(C1=CS(C=C1c2c(C)cc(cc2)O)(=O)=O)cc3)C
InChi:	InChI=1S/C18H16O4S/c1-11-7-13(19)3-5-15(11)17-9-23(21,22)10-18(17)16-6-4-14(20)8-12(16)2/h3-10,19-20H,1-2H3
Definition date:	2015-09-22
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	3,4-bis(4-hydroxy-2-methylphenyl)-1H-1lambda~6~-thiophene-1,1-dione

5G2

5G2
Name:	3,4-bis(2-chloro-4-hydroxyphenyl)-1H-1lambda~6~-thiophene-1,1-dione
Formula:	C16 H10 Cl2 O4 S
SMILES:	C=1S(C=C(C=1c2c(Cl)cc(O)cc2)c3c(Cl)cc(O)cc3)(=O)=O
InChi:	InChI=1S/C16H10Cl2O4S/c17-15-5-9(19)1-3-11(15)13-7-23(21,22)8-14(13)12-4-2-10(20)6-16(12)18/h1-8,19-20H
Definition date:	2015-09-22
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	3,4-bis(2-chloro-4-hydroxyphenyl)-1H-1lambda~6~-thiophene-1,1-dione

5G3

5G3
Name:	4-[(E)-[(2-chlorophenyl)imino](4-hydroxyphenyl)methyl]benzene-1,3-diol
Formula:	C19 H14 Cl N O3
SMILES:	Oc3ccc(/C(c1c(cc(cc1)O)O)=Nc2c(Cl)cccc2)cc3
InChi:	InChI=1S/C19H14ClNO3/c20-16-3-1-2-4-17(16)21-19(12-5-7-13(22)8-6-12)15-10-9-14(23)11-18(15)24/h1-11,22-24H/b21-19+
Definition date:	2015-09-22
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4-[(E)-[(2-chlorophenyl)imino](4-hydroxyphenyl)methyl]benzene-1,3-diol

5G4

5G4
Name:	4-{(E)-(4-hydroxyphenyl)[(2-methylphenyl)imino]methyl}benzene-1,3-diol
Formula:	C20 H17 N O3
SMILES:	Oc3ccc(/C(c1c(cc(cc1)O)O)=Nc2c(C)cccc2)cc3
InChi:	InChI=1S/C20H17NO3/c1-13-4-2-3-5-18(13)21-20(14-6-8-15(22)9-7-14)17-11-10-16(23)12-19(17)24/h2-12,22-24H,1H3/b21-20+
Definition date:	2015-09-22
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4-{(E)-(4-hydroxyphenyl)[(2-methylphenyl)imino]methyl}benzene-1,3-diol

5G5

5G5
Name:	4,4'-[(2-chlorophenyl)carbonimidoyl]diphenol
Formula:	C19 H14 Cl N O2
SMILES:	Clc1c(cccc1)N=C(c2ccc(O)cc2)c3ccc(cc3)O
InChi:	InChI=1S/C19H14ClNO2/c20-17-3-1-2-4-18(17)21-19(13-5-9-15(22)10-6-13)14-7-11-16(23)12-8-14/h1-12,22-23H
Definition date:	2015-09-22
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-[(2-chlorophenyl)carbonimidoyl]diphenol

5G6

5G6
Name:	4,4'-(phenylcarbonimidoyl)diphenol
Formula:	C19 H15 N O2
SMILES:	Oc3ccc(C(=N/c1ccccc1)c2ccc(O)cc2)cc3
InChi:	InChI=1S/C19H15NO2/c21-17-10-6-14(7-11-17)19(15-8-12-18(22)13-9-15)20-16-4-2-1-3-5-16/h1-13,21-22H
Definition date:	2015-09-22
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-(phenylcarbonimidoyl)diphenol

5G7

5G7
Name:	4,4'-[(2-methylphenyl)carbonimidoyl]diphenol
Formula:	C20 H17 N O2
SMILES:	Oc1ccc(cc1)/C(c2ccc(cc2)O)=N/c3c(C)cccc3
InChi:	InChI=1S/C20H17NO2/c1-14-4-2-3-5-19(14)21-20(15-6-10-17(22)11-7-15)16-8-12-18(23)13-9-16/h2-13,22-23H,1H3
Definition date:	2015-09-22
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-[(2-methylphenyl)carbonimidoyl]diphenol

5HW

5HW
Name:	4,4'-{[(3R)-3-methylcyclohexylidene]methanediyl}diphenol
Formula:	C20 H22 O2
SMILES:	Oc1ccc(cc1)/C(c2ccc(O)cc2)=C3/CC(CCC3)C
InChi:	InChI=1S/C20H22O2/c1-14-3-2-4-17(13-14)20(15-5-9-18(21)10-6-15)16-7-11-19(22)12-8-16/h5-12,14,21-22H,2-4,13H2,1H3/t14-/m1/s1
Definition date:	2015-09-28
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-{[(3R)-3-methylcyclohexylidene]methanediyl}diphenol

5HX

5HX
Name:	4-[(E)-(1s,5s)-bicyclo[3.3.1]non-9-ylidene(phenyl)methyl]phenol
Formula:	C22 H24 O
SMILES:	C1C2CCCC(CC1)/C2=C(c3ccc(O)cc3)c4ccccc4
InChi:	InChI=1S/C22H24O/c23-20-14-12-19(13-15-20)22(16-6-2-1-3-7-16)21-17-8-4-9-18(21)11-5-10-17/h1-3,6-7,12-15,17-18,23H,4-5,8-11H2/b22-21-/t17-,18+
Definition date:	2015-09-28
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4-[(E)-(1s,5s)-bicyclo[3.3.1]non-9-ylidene(phenyl)methyl]phenol

5HZ

5HZ
Name:	4,4'-[(1s,5s)-bicyclo[3.3.1]non-9-ylidenemethanediyl]diphenol
Formula:	C22 H24 O2
SMILES:	C1CCC2CCCC1C/2=C(/c3ccc(O)cc3)c4ccc(cc4)O
InChi:	InChI=1S/C22H24O2/c23-19-11-7-17(8-12-19)22(18-9-13-20(24)14-10-18)21-15-3-1-4-16(21)6-2-5-15/h7-16,23-24H,1-6H2/t15-,16+
Definition date:	2015-09-28
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-[(1s,5s)-bicyclo[3.3.1]non-9-ylidenemethanediyl]diphenol

5J0

5J0
Name:	3-[(E)-(1s,5s)-bicyclo[3.3.1]non-9-ylidene(4-hydroxyphenyl)methyl]phenol
Formula:	C22 H24 O2
SMILES:	C1CCC2CCCC1C/2=C(/c3cccc(c3)O)c4ccc(cc4)O
InChi:	InChI=1S/C22H24O2/c23-19-12-10-17(11-13-19)22(18-8-3-9-20(24)14-18)21-15-4-1-5-16(21)7-2-6-15/h3,8-16,23-24H,1-2,4-7H2/b22-21-/t15-,16+
Definition date:	2015-09-28
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	3-[(E)-(1s,5s)-bicyclo[3.3.1]non-9-ylidene(4-hydroxyphenyl)methyl]phenol

5J1

5J1
Name:	4,4'-[(9s)-bicyclo[3.3.1]non-9-ylmethanediyl]diphenol
Formula:	C22 H26 O2
SMILES:	C1CCC2CCCC1C2C(c3ccc(O)cc3)c4ccc(cc4)O
InChi:	InChI=1S/C22H26O2/c23-19-11-7-17(8-12-19)22(18-9-13-20(24)14-10-18)21-15-3-1-4-16(21)6-2-5-15/h7-16,21-24H,1-6H2/t15-,16+,21-
Definition date:	2015-09-28
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-[(9s)-bicyclo[3.3.1]non-9-ylmethanediyl]diphenol

5J2

5J2
Name:	4-[(E)-[(4-fluorophenyl)imino](4-hydroxyphenyl)methyl]benzene-1,3-diol
Formula:	C19 H14 F N O3
SMILES:	Oc1ccc(cc1)C(=N/c2ccc(F)cc2)c3c(cc(cc3)O)O
InChi:	InChI=1S/C19H14FNO3/c20-13-3-5-14(6-4-13)21-19(12-1-7-15(22)8-2-12)17-10-9-16(23)11-18(17)24/h1-11,22-24H/b21-19+
Definition date:	2015-09-28
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4-[(E)-[(4-fluorophenyl)imino](4-hydroxyphenyl)methyl]benzene-1,3-diol

5JX

5JX
Name:	4,4'-{[4-(fluoromethyl)cyclohexylidene]methanediyl}diphenol
Formula:	C20 H21 F O2
SMILES:	Oc3ccc(/C(c1ccc(cc1)O)=C2/CCC(CC2)CF)cc3
InChi:	InChI=1S/C20H21FO2/c21-13-14-1-3-15(4-2-14)20(16-5-9-18(22)10-6-16)17-7-11-19(23)12-8-17/h5-12,14,22-23H,1-4,13H2
Definition date:	2015-10-06
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-{[4-(fluoromethyl)cyclohexylidene]methanediyl}diphenol

5JY

5JY
Name:	4,4'-[(4-ethylcyclohexylidene)methanediyl]diphenol
Formula:	C21 H24 O2
SMILES:	Oc3ccc(/C(c1ccc(O)cc1)=C2/CCC(CC)CC2)cc3
InChi:	InChI=1S/C21H24O2/c1-2-15-3-5-16(6-4-15)21(17-7-11-19(22)12-8-17)18-9-13-20(23)14-10-18/h7-15,22-23H,2-6H2,1H3
Definition date:	2015-10-06
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-[(4-ethylcyclohexylidene)methanediyl]diphenol

5K0

5K0
Name:	4,4'-[(4-methylcyclohexylidene)methanediyl]diphenol
Formula:	C20 H22 O2
SMILES:	Oc3ccc(/C(c1ccc(O)cc1)=C2/CCC(CC2)C)cc3
InChi:	InChI=1S/C20H22O2/c1-14-2-4-15(5-3-14)20(16-6-10-18(21)11-7-16)17-8-12-19(22)13-9-17/h6-14,21-22H,2-5H2,1H3
Definition date:	2015-10-06
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-[(4-methylcyclohexylidene)methanediyl]diphenol

5K1

5K1
Name:	4,4'-{[(3S)-3-(methylsulfanyl)cyclohexylidene]methanediyl}diphenol
Formula:	C20 H22 O2 S
SMILES:	Oc1ccc(cc1)/C(c2ccc(cc2)O)=C3/CC(CCC3)SC
InChi:	InChI=1S/C20H22O2S/c1-23-19-4-2-3-16(13-19)20(14-5-9-17(21)10-6-14)15-7-11-18(22)12-8-15/h5-12,19,21-22H,2-4,13H2,1H3/t19-/m0/s1
Definition date:	2015-10-06
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-{[(3S)-3-(methylsulfanyl)cyclohexylidene]methanediyl}diphenol

5K2

5K2
Name:	4,4'-(3,4-dihydronaphthalen-2(1H)-ylidenemethanediyl)diphenol
Formula:	C23 H20 O2
SMILES:	C2Cc1ccccc1CC/2=C(c3ccc(cc3)O)c4ccc(cc4)O
InChi:	InChI=1S/C23H20O2/c24-21-11-7-17(8-12-21)23(18-9-13-22(25)14-10-18)20-6-5-16-3-1-2-4-19(16)15-20/h1-4,7-14,24-25H,5-6,15H2
Definition date:	2015-10-06
Last modified:	2016-04-29
Release date:	2016-05-04
Identifier:	4,4'-(3,4-dihydronaphthalen-2(1H)-ylidenemethanediyl)diphenol

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