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A1LVF

A1LVF
Name:	2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl (Z)-octadec-9-enoate
Formula:	C57 H104 O6
SMILES:	CCCCCCCCC=CCCCCCCCC(=O)OC[CH](COC(=O)CCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCC=CCCCCCCCC
InChi:	InChI=1S/C57H104O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h25-30,54H,4-24,31-53H2,1-3H3/b28-25-,29-26-,30-27-
Synonyms:	Glyceryl trioleate
Definition date:	2023-12-20
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	2,3-bis[[(~{Z})-octadec-9-enoyl]oxy]propyl (~{Z})-octadec-9-enoate

A1B7Q

A1B7Q
Name:	(2S)-1-{4-[(7P)-7-(8-ethynyl-7-fluoro-3-hydroxynaphthalen-1-yl)-8-fluoro-2-{[(2R,4R,7aS)-2-fluorotetrahydro-1H-pyrrolizin-7a(5H)-yl]methoxy}pyrido[4,3-d]pyrimidin-4-yl]piperazin-1-yl}-2-fluoro-3-(1,3-thiazol-2-yl)propan-1-one
Formula:	C37 H33 F4 N7 O3 S
SMILES:	FC(Cc1nccs1)C(=O)N1CCN(CC1)c1nc(OCC23CCCN3CC(F)C2)nc2c1cnc(c1cc(O)cc3ccc(F)c(C#C)c31)c2F
InChi:	InChI=1S/C37H33F4N7O3S/c1-2-24-27(39)5-4-21-14-23(49)15-25(30(21)24)32-31(41)33-26(18-43-32)34(45-36(44-33)51-20-37-6-3-8-48(37)19-22(38)17-37)46-9-11-47(12-10-46)35(50)28(40)16-29-42-7-13-52-29/h1,4-5,7,13-15,18,22,28,49H,3,6,8-12,16-17,19-20H2/t22-,28+,37+/m1/s1
Synonyms:	(2R)-1-{4-[(7P)-7-(8-ethynyl-7-fluoro-3-hydroxynaphthalen-1-yl)-8-fluoro-2-{[(2R,4R,7aS)-2-fluorotetrahydro-1H-pyrrolizin-7a(5H)-yl]methoxy}pyrido[4,3-d]pyrimidin-4-yl]piperazin-1-yl}-2-fluoro-3-(1,3-thiazol-2-yl)propan-1-one adduct
Definition date:	2025-04-02
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	(2S)-1-{4-[(7P)-7-(8-ethynyl-7-fluoro-3-hydroxynaphthalen-1-yl)-8-fluoro-2-{[(2R,4R,7aS)-2-fluorotetrahydro-1H-pyrrolizin-7a(5H)-yl]methoxy}pyrido[4,3-d]pyrimidin-4-yl]piperazin-1-yl}-2-fluoro-3-(1,3-thiazol-2-yl)propan-1-one

A1BXA

A1BXA
Name:	4-{[5-amino-1-(3-{[fluorodi(hydroxy)-lambda~4~-sulfanyl]oxy}benzoyl)-1H-1,2,4-triazol-3-yl]amino}benzene-1-sulfonamide
Formula:	C15 H15 F N6 O6 S2
SMILES:	O=C(c1cccc(OS(F)(O)O)c1)n1nc(Nc2ccc(cc2)S(N)(=O)=O)nc1N
InChi:	InChI=1S/C15H15FN6O6S2/c16-30(26,27)28-11-3-1-2-9(8-11)13(23)22-14(17)20-15(21-22)19-10-4-6-12(7-5-10)29(18,24)25/h1-8,26-27H,(H2,18,24,25)(H3,17,19,20,21)
Definition date:	2025-02-18
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	4-{[5-amino-1-(3-{[fluorodi(hydroxy)-lambda~4~-sulfanyl]oxy}benzoyl)-1H-1,2,4-triazol-3-yl]amino}benzene-1-sulfonamide

A1CDQ

A1CDQ
Name:	(3R,4S)-4-phenoxypyrrolidin-3-ol
Formula:	C10 H13 N O2
SMILES:	OC1CNCC1Oc1ccccc1
InChi:	InChI=1S/C10H13NO2/c12-9-6-11-7-10(9)13-8-4-2-1-3-5-8/h1-5,9-12H,6-7H2/t9-,10+/m1/s1
Definition date:	2025-05-21
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	(3R,4S)-4-phenoxypyrrolidin-3-ol

A1CDR

A1CDR
Name:	1-(1-ethyl-1H-pyrrol-3-yl)methanamine
Formula:	C7 H12 N2
SMILES:	NCc1ccn(CC)c1
InChi:	InChI=1S/C7H12N2/c1-2-9-4-3-7(5-8)6-9/h3-4,6H,2,5,8H2,1H3
Definition date:	2025-05-21
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	1-(1-ethyl-1H-pyrrol-3-yl)methanamine

A1CDT

A1CDT
Name:	N-(2-aminoethyl)thiophene-2-carboxamide
Formula:	C7 H10 N2 O S
SMILES:	O=C(NCCN)c1cccs1
InChi:	InChI=1S/C7H10N2OS/c8-3-4-9-7(10)6-2-1-5-11-6/h1-2,5H,3-4,8H2,(H,9,10)
Definition date:	2025-05-21
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	N-(2-aminoethyl)thiophene-2-carboxamide

A1CDX

A1CDX
Name:	2-[(1S)-2,2-difluorocyclopentyl]ethan-1-amine
Formula:	C7 H13 F2 N
SMILES:	FC1(F)CCCC1CCN
InChi:	InChI=1S/C7H13F2N/c8-7(9)4-1-2-6(7)3-5-10/h6H,1-5,10H2/t6-/m0/s1
Definition date:	2025-05-21
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	2-[(1S)-2,2-difluorocyclopentyl]ethan-1-amine

A1CFE

A1CFE
Name:	(S)-1-(4-methoxyphenyl)-1-(1-methyl-1H-imidazol-2-yl)methanamine
Formula:	C12 H15 N3 O
SMILES:	NC(c1ccc(OC)cc1)c1nccn1C
InChi:	InChI=1S/C12H15N3O/c1-15-8-7-14-12(15)11(13)9-3-5-10(16-2)6-4-9/h3-8,11H,13H2,1-2H3/t11-/m0/s1
Definition date:	2025-06-09
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	(S)-1-(4-methoxyphenyl)-1-(1-methyl-1H-imidazol-2-yl)methanamine

A1CFG

A1CFG
Name:	4-[(2-fluorophenyl)methyl]-4,5-dihydropyrazin-2(3H)-one
Formula:	C11 H11 F N2 O
SMILES:	Fc1ccccc1CN1CC=NC(=O)C1
InChi:	InChI=1S/C11H11FN2O/c12-10-4-2-1-3-9(10)7-14-6-5-13-11(15)8-14/h1-5H,6-8H2
Definition date:	2025-06-09
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	4-[(2-fluorophenyl)methyl]-4,5-dihydropyrazin-2(3H)-one

A1CFR

A1CFR
Name:	(1r,4r)-N-methyl-4-(trifluoromethyl)cyclohexan-1-amine
Formula:	C8 H14 F3 N
SMILES:	CNC1CCC(CC1)C(F)(F)F
InChi:	InChI=1S/C8H14F3N/c1-12-7-4-2-6(3-5-7)8(9,10)11/h6-7,12H,2-5H2,1H3/t6-,7-
Definition date:	2025-06-09
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	(1r,4r)-N-methyl-4-(trifluoromethyl)cyclohexan-1-amine

A1CFS

A1CFS
Name:	2-(azetidin-3-yl)-1H-imidazole
Formula:	C6 H9 N3
SMILES:	n1cc[NH]c1C1CNC1
InChi:	InChI=1S/C6H9N3/c1-2-9-6(8-1)5-3-7-4-5/h1-2,5,7H,3-4H2,(H,8,9)
Definition date:	2025-06-09
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	2-(azetidin-3-yl)-1H-imidazole

A1CFV

A1CFV
Name:	N-methyl-5-[(methylamino)methyl]furan-2-carboxamide
Formula:	C8 H12 N2 O2
SMILES:	CNCc1ccc(o1)C(=O)NC
InChi:	InChI=1S/C8H12N2O2/c1-9-5-6-3-4-7(12-6)8(11)10-2/h3-4,9H,5H2,1-2H3,(H,10,11)
Definition date:	2025-06-09
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	N-methyl-5-[(methylamino)methyl]furan-2-carboxamide

A1CFY

A1CFY
Name:	2-propylpyrimidin-4-amine
Formula:	C7 H11 N3
SMILES:	CCCc1nc(N)ccn1
InChi:	InChI=1S/C7H11N3/c1-2-3-7-9-5-4-6(8)10-7/h4-5H,2-3H2,1H3,(H2,8,9,10)
Definition date:	2025-06-09
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	2-propylpyrimidin-4-amine

A1CFZ

A1CFZ
Name:	(4aS,8aR)-octahydroquinoxalin-2(1H)-one
Formula:	C8 H14 N2 O
SMILES:	O=C1NC2CCCCC2NC1
InChi:	InChI=1S/C8H14N2O/c11-8-5-9-6-3-1-2-4-7(6)10-8/h6-7,9H,1-5H2,(H,10,11)/t6-,7+/m0/s1
Definition date:	2025-06-09
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	(4aS,8aR)-octahydroquinoxalin-2(1H)-one

A1CG7

A1CG7
Name:	7-amino-1-methyl-3-{[(1H-tetrazol-5-yl)amino]methyl}pyrimido[4,5-c]pyridazine-4,5(1H,6H)-dione
Formula:	C9 H10 N10 O2
SMILES:	O=C1C(=NN(C)C=2N=C(N)NC(=O)C1=2)CNc1nnn[NH]1
InChi:	InChI=1S/C9H10N10O2/c1-19-6-4(7(21)13-8(10)12-6)5(20)3(16-19)2-11-9-14-17-18-15-9/h2H2,1H3,(H3,10,12,13,21)(H2,11,14,15,17,18)
Definition date:	2025-06-19
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	7-amino-1-methyl-3-{[(1H-tetrazol-5-yl)amino]methyl}pyrimido[4,5-c]pyridazine-4,5(1H,6H)-dione

A1CGS

A1CGS
Name:	2-(4-chloro-3-methylphenoxy)-N-ethylethan-1-amine
Formula:	C11 H16 Cl N O
SMILES:	Cc1cc(OCCNCC)ccc1Cl
InChi:	InChI=1S/C11H16ClNO/c1-3-13-6-7-14-10-4-5-11(12)9(2)8-10/h4-5,8,13H,3,6-7H2,1-2H3
Definition date:	2025-06-13
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	2-(4-chloro-3-methylphenoxy)-N-ethylethan-1-amine

A1CGV

A1CGV
Name:	2-[4-(benzyloxy)phenoxy]-N-ethylethan-1-amine
Formula:	C17 H21 N O2
SMILES:	CCNCCOc1ccc(cc1)OCc1ccccc1
InChi:	InChI=1S/C17H21NO2/c1-2-18-12-13-19-16-8-10-17(11-9-16)20-14-15-6-4-3-5-7-15/h3-11,18H,2,12-14H2,1H3
Definition date:	2025-06-13
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	2-[4-(benzyloxy)phenoxy]-N-ethylethan-1-amine

A1CNT

A1CNT
Name:	[(3R,4R,5R)-4-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)oxolan-3-yl]methyl dihydrogen phosphate
Formula:	C10 H15 N2 O8 P
SMILES:	O=P(O)(O)OCC1COC(N2C=C(C)C(=O)NC2=O)C1O
InChi:	InChI=1S/C10H15N2O8P/c1-5-2-12(10(15)11-8(5)14)9-7(13)6(3-19-9)4-20-21(16,17)18/h2,6-7,9,13H,3-4H2,1H3,(H,11,14,15)(H2,16,17,18)/t6-,7-,9-/m1/s1
Definition date:	2025-08-19
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	[(3R,4R,5R)-4-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)oxolan-3-yl]methyl dihydrogen phosphate

A1EFZ

A1EFZ
Name:	1-[1-[4-(imidazol-1-ylmethyl)-3,5-dimethoxy-phenyl]indolizin-3-yl]propan-1-one
Formula:	C23 H23 N3 O3
SMILES:	CCC(=O)c1cc(c2cc(OC)c(Cn3ccnc3)c(OC)c2)c4ccccn14
InChi:	InChI=1S/C23H23N3O3/c1-4-21(27)20-13-17(19-7-5-6-9-26(19)20)16-11-22(28-2)18(23(12-16)29-3)14-25-10-8-24-15-25/h5-13,15H,4,14H2,1-3H3
Definition date:	2024-11-19
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	1-[1-[4-(imidazol-1-ylmethyl)-3,5-dimethoxy-phenyl]indolizin-3-yl]propan-1-one

A1EHA

A1EHA
Name:	1-[1-[2,5-dimethoxy-4-[(1~{S})-1-oxidanylethyl]phenyl]indolizin-3-yl]ethanone
Formula:	C20 H21 N O4
SMILES:	COc1cc(c(OC)cc1[CH](C)O)c2cc(n3ccccc23)C(C)=O
InChi:	InChI=1S/C20H21NO4/c1-12(22)14-10-20(25-4)16(11-19(14)24-3)15-9-18(13(2)23)21-8-6-5-7-17(15)21/h5-12,22H,1-4H3/t12-/m0/s1
Definition date:	2024-12-09
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	1-[1-[2,5-dimethoxy-4-[(1~{S})-1-oxidanylethyl]phenyl]indolizin-3-yl]ethanone

A1EMX

A1EMX
Name:	2,4-dimethyl-3-[2-(2-methylpyrimidin-5-yl)-1~{H}-pyrrolo[2,3-b]pyridin-5-yl]phenol
Formula:	C20 H18 N4 O
SMILES:	Cc1ccc(O)c(C)c1c2cnc3[nH]c(cc3c2)c4cnc(C)nc4
InChi:	InChI=1S/C20H18N4O/c1-11-4-5-18(25)12(2)19(11)15-6-14-7-17(24-20(14)23-8-15)16-9-21-13(3)22-10-16/h4-10,25H,1-3H3,(H,23,24)
Definition date:	2025-03-11
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	2,4-dimethyl-3-[2-(2-methylpyrimidin-5-yl)-1~{H}-pyrrolo[2,3-b]pyridin-5-yl]phenol

A1EW5

A1EW5
Name:	[(2~{S})-2-[(~{Z})-octadec-9-enoyl]oxy-3-oxidanyl-propyl] (~{Z})-octadec-9-enoate
Formula:	C39 H72 O5
SMILES:	CCCCCCCCC=CCCCCCCCC(=O)OC[CH](CO)OC(=O)CCCCCCCC=CCCCCCCCC
InChi:	InChI=1S/C39H72O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,37,40H,3-16,21-36H2,1-2H3/b19-17-,20-18-/t37-/m0/s1
Synonyms:	1,2-Dioleoyl-sn-glycerol
Definition date:	2025-09-05
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	[(2~{S})-2-[(~{Z})-octadec-9-enoyl]oxy-3-oxidanyl-propyl] (~{Z})-octadec-9-enoate

A1EWS

A1EWS
Name:	(6-bromanylpyridin-3-yl)-[1'-[(~{E})-3-(4-chlorophenyl)prop-2-enyl]-5-fluoranyl-spiro[2~{H}-indole-3,4'-piperidine]-1-yl]methanone
Formula:	C27 H24 Br Cl F N3 O
SMILES:	Fc1ccc2N(CC3(CCN(CC3)CC=Cc4ccc(Cl)cc4)c2c1)C(=O)c5ccc(Br)nc5
InChi:	InChI=1S/C27H24BrClFN3O/c28-25-10-5-20(17-31-25)26(34)33-18-27(23-16-22(30)8-9-24(23)33)11-14-32(15-12-27)13-1-2-19-3-6-21(29)7-4-19/h1-10,16-17H,11-15,18H2/b2-1+
Definition date:	2025-09-02
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	(6-bromanylpyridin-3-yl)-[1'-[(~{E})-3-(4-chlorophenyl)prop-2-enyl]-5-fluoranyl-spiro[2~{H}-indole-3,4'-piperidine]-1-yl]methanone

A1EWW

A1EWW
Name:	2-(3-ethylsulfonylpyridin-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine
Formula:	C15 H13 F3 N4 O2 S
SMILES:	CC[S](=O)(=O)c1cccnc1c2nc3cc(cnc3n2C)C(F)(F)F
InChi:	InChI=1S/C15H13F3N4O2S/c1-3-25(23,24)11-5-4-6-19-12(11)14-21-10-7-9(15(16,17)18)8-20-13(10)22(14)2/h4-8H,3H2,1-2H3
Definition date:	2025-09-02
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	2-(3-ethylsulfonylpyridin-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine

A1I59

A1I59
Name:	[(2~{R},3~{S},4~{R},5~{R})-5-[4-azanyl-5-[(1~{S})-1-azanyl-3,3-bis(oxidanyl)propyl]-2-oxidanylidene-pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate
Formula:	C12 H21 N4 O10 P
SMILES:	N[CH](CC(O)O)C1=CN([CH]2O[CH](CO[P](O)(O)=O)[CH](O)[CH]2O)C(=O)N=C1N
InChi:	InChI=1S/C12H21N4O10P/c13-5(1-7(17)18)4-2-16(12(21)15-10(4)14)11-9(20)8(19)6(26-11)3-25-27(22,23)24/h2,5-9,11,17-20H,1,3,13H2,(H2,14,15,21)(H2,22,23,24)/t5-,6+,8+,9+,11+/m0/s1
Definition date:	2025-03-17
Last modified:	2025-10-31
Release date:	2025-11-05
Identifier:	[(2~{R},3~{S},4~{R},5~{R})-5-[4-azanyl-5-[(1~{S})-1-azanyl-3,3-bis(oxidanyl)propyl]-2-oxidanylidene-pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate

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