3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine

C152H151Cl3F2N12O2 — CID 158198503

IUPAC3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine
SMILESCNC1CC(C2=CCc3c(Cl)cccc32)c2ccccc21.CNC1CC(C2=CCc3c(OC)cccc32)c2ccccc21.CNC1CC(C2=CCc3ccc(F)cc32)c2ccccc21.CNC1CC(C2=CCc3cccc(Cl)c32)c2ccccc21.CNC1CC(c2c(C)[nH]c3ccc(F)cc23)c2ccccc21.CNC1CC(c2c[nH]c3c(OC)cccc23)c2ccc(Cl)cc21.CNC1CC(c2cn(C)c3ccccc23)c2ccccc21.CN[C@H]1C[C@@H](c2c[nH]c3ccccc23)c2ccccc21
InChIInChI=1S/C20H21NO.C19H19ClN2O.2C19H18ClN.C19H19FN2.C19H18FN.C19H20N2.C18H18N2/c1-21-19-12-18(14-6-3-4-7-16(14)19)15-10-11-17-13(15)8-5-9-20(17)22-2;1-21-17-9-14(12-7-6-11(20)8-15(12)17)16-10-22-19-13(16)4-3-5-18(19)23-2;1-21-18-11-16(13-6-2-3-7-14(13)18)15-10-9-12-5-4-8-17(20)19(12)15;1-21-19-11-17(13-5-2-3-6-16(13)19)14-9-10-15-12(14)7-4-8-18(15)20;1-11-19(16-9-12(20)7-8-17(16)22-11)15-10-18(21-2)14-6-4-3-5-13(14)15;1-21-19-11-18(14-4-2-3-5-16(14)19)15-9-7-12-6-8-13(20)10-17(12)15;1-20-18-11-16(13-7-3-4-8-14(13)18)17-12-21(2)19-10-6-5-9-15(17)19;1-19-18-10-15(12-6-2-3-7-13(12)18)16-11-20-17-9-5-4-8-14(16)17/h3-10,18-19,21H,11-12H2,1-2H3;3-8,10,14,17,21-22H,9H2,1-2H3;2-8,10,16,18,21H,9,11H2,1H3;2-9,17,19,21H,10-11H2,1H3;3-9,15,18,21-22H,10H2,1-2H3;2-6,8-10,18-19,21H,7,11H2,1H3;3-10,12,16,18,20H,11H2,1-2H3;2-9,11,15,18-20H,10H2,1H3/t;;;;;;;15-,18+/m.......1/s1
InChIKeyGAQFQAQUXBASQT-VGUGLHHPSA-N
MW2322.32 g/mol
LogP34.73
Rot. Bonds18

About 3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine

3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 158198503) has the molecular formula C152H151Cl3F2N12O2 and a molecular weight of 2322.32 g/mol. Its IUPAC name is 3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine
PubChem CID158198503
Molecular FormulaC152H151Cl3F2N12O2
Molecular Weight2322.32 g/mol
Exact Mass2319.11
IUPAC Name3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine
SMILESCNC1CC(C2=CCc3c(Cl)cccc32)c2ccccc21.CNC1CC(C2=CCc3c(OC)cccc32)c2ccccc21.CNC1CC(C2=CCc3ccc(F)cc32)c2ccccc21.CNC1CC(C2=CCc3cccc(Cl)c32)c2ccccc21.CNC1CC(c2c(C)[nH]c3ccc(F)cc23)c2ccccc21.CNC1CC(c2c[nH]c3c(OC)cccc23)c2ccc(Cl)cc21.CNC1CC(c2cn(C)c3ccccc23)c2ccccc21.CN[C@H]1C[C@@H](c2c[nH]c3ccccc23)c2ccccc21
InChIInChI=1S/C20H21NO.C19H19ClN2O.2C19H18ClN.C19H19FN2.C19H18FN.C19H20N2.C18H18N2/c1-21-19-12-18(14-6-3-4-7-16(14)19)15-10-11-17-13(15)8-5-9-20(17)22-2;1-21-17-9-14(12-7-6-11(20)8-15(12)17)16-10-22-19-13(16)4-3-5-18(19)23-2;1-21-18-11-16(13-6-2-3-7-14(13)18)15-10-9-12-5-4-8-17(20)19(12)15;1-21-19-11-17(13-5-2-3-6-16(13)19)14-9-10-15-12(14)7-4-8-18(15)20;1-11-19(16-9-12(20)7-8-17(16)22-11)15-10-18(21-2)14-6-4-3-5-13(14)15;1-21-19-11-18(14-4-2-3-5-16(14)19)15-9-7-12-6-8-13(20)10-17(12)15;1-20-18-11-16(13-7-3-4-8-14(13)18)17-12-21(2)19-10-6-5-9-15(17)19;1-19-18-10-15(12-6-2-3-7-13(12)18)16-11-20-17-9-5-4-8-14(16)17/h3-10,18-19,21H,11-12H2,1-2H3;3-8,10,14,17,21-22H,9H2,1-2H3;2-8,10,16,18,21H,9,11H2,1H3;2-9,17,19,21H,10-11H2,1H3;3-9,15,18,21-22H,10H2,1-2H3;2-6,8-10,18-19,21H,7,11H2,1H3;3-10,12,16,18,20H,11H2,1-2H3;2-9,11,15,18-20H,10H2,1H3/t;;;;;;;15-,18+/m.......1/s1
InChIKeyGAQFQAQUXBASQT-VGUGLHHPSA-N
XLogP34.73
TPSA167.00 Ų
H-Bond Donors11
H-Bond Acceptors11
Rotatable Bonds18
Heavy Atoms171
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002322.32
LogP ≤ 534.73
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze 3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine (CID 158198503) is 3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine is CNC1CC(C2=CCc3c(Cl)cccc32)c2ccccc21.CNC1CC(C2=CCc3c(OC)cccc32)c2ccccc21.CNC1CC(C2=CCc3ccc(F)cc32)c2ccccc21.CNC1CC(C2=CCc3cccc(Cl)c32)c2ccccc21.CNC1CC(c2c(C)[nH]c3ccc(F)cc23)c2ccccc21.CNC1CC(c2c[nH]c3c(OC)cccc23)c2ccc(Cl)cc21.CNC1CC(c2cn(C)c3ccccc23)c2ccccc21.CN[C@H]1C[C@@H](c2c[nH]c3ccccc23)c2ccccc21.
What is the InChIKey of 3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is GAQFQAQUXBASQT-VGUGLHHPSA-N. The full InChI is InChI=1S/C20H21NO.C19H19ClN2O.2C19H18ClN.C19H19FN2.C19H18FN.C19H20N2.C18H18N2/c1-21-19-12-18(14-6-3-4-7-16(14)19)15-10-11-17-13(15)8-5-9-20(17)22-2;1-21-17-9-14(12-7-6-11(20)8-15(12)17)16-10-22-19-13(16)4-3-5-18(19)23-2;1-21-18-11-16(13-6-2-3-7-14(13)18)15-10-9-12-5-4-8-17(20)19(12)15;1-21-19-11-17(13-5-2-3-6-16(13)19)14-9-10-15-12(14)7-4-8-18(15)20;1-11-19(16-9-12(20)7-8-17(16)22-11)15-10-18(21-2)14-6-4-3-5-13(14)15;1-21-19-11-18(14-4-2-3-5-16(14)19)15-9-7-12-6-8-13(20)10-17(12)15;1-20-18-11-16(13-7-3-4-8-14(13)18)17-12-21(2)19-10-6-5-9-15(17)19;1-19-18-10-15(12-6-2-3-7-13(12)18)16-11-20-17-9-5-4-8-14(16)17/h3-10,18-19,21H,11-12H2,1-2H3;3-8,10,14,17,21-22H,9H2,1-2H3;2-8,10,16,18,21H,9,11H2,1H3;2-9,17,19,21H,10-11H2,1H3;3-9,15,18,21-22H,10H2,1-2H3;2-6,8-10,18-19,21H,7,11H2,1H3;3-10,12,16,18,20H,11H2,1-2H3;2-9,11,15,18-20H,10H2,1H3/t;;;;;;;15-,18+/m.......1/s1.
What are the key properties of 3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine?
3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 2322.32 g/mol, XLogP of 34.73, 18 rotatable bonds, 11 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(7-chloro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;6-chloro-3-(7-methoxy-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(6-fluoro-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(5-fluoro-2-methyl-1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;(1S,3R)-3-(1H-indol-3-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;3-(4-methoxy-3H-inden-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine;N-methyl-3-(1-methylindol-3-yl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 158198503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).