3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine

C109H112Cl6N26O8 — CID 158393903

IUPAC3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine
SMILESC.C1COCCN1.O=C(CCc1ncn2ccc(Cl)cc12)c1cn[nH]c1.O=C(CCc1ncn2ccc(Cl)cc12)c1cnn(Cc2cn3cc(C4CC4)cc(CCl)c3n2)c1.O=C(CCc1ncn2ccc(Cl)cc12)c1cnn(Cc2cn3cc(C4CC4)cc(CN4CCOCC4)c3n2)c1.O=C(CCc1ncn2ccc(Cl)cc12)c1cnn(Cc2cn3cc(C4CC4)cc(CO)c3n2)c1.OCc1cc(C2CC2)cn2cc(CCl)nc12
InChIInChI=1S/C29H30ClN7O2.C25H22Cl2N6O.C25H23ClN6O2.C13H11ClN4O.C12H13ClN2O.C4H9NO.CH4/c30-24-5-6-35-19-31-26(27(35)12-24)3-4-28(38)23-13-32-37(16-23)18-25-17-36-15-21(20-1-2-20)11-22(29(36)33-25)14-34-7-9-39-10-8-34;26-9-17-7-18(16-1-2-16)11-32-13-21(30-25(17)32)14-33-12-19(10-29-33)24(34)4-3-22-23-8-20(27)5-6-31(23)15-28-22;26-20-5-6-30-15-27-22(23(30)8-20)3-4-24(34)19-9-28-32(11-19)13-21-12-31-10-17(16-1-2-16)7-18(14-33)25(31)29-21;14-10-3-4-18-8-15-11(12(18)5-10)1-2-13(19)9-6-16-17-7-9;13-4-11-6-15-5-9(8-1-2-8)3-10(7-16)12(15)14-11;1-3-6-4-2-5-1;/h5-6,11-13,15-17,19-20H,1-4,7-10,14,18H2;5-8,10-13,15-16H,1-4,9,14H2;5-12,15-16,33H,1-4,13-14H2;3-8H,1-2H2,(H,16,17);3,5-6,8,16H,1-2,4,7H2;5H,1-4H2;1H4
InChIKeyGXHOFBXRRIYQKG-UHFFFAOYSA-N
MW2126.99 g/mol
LogP18.99
Rot. Bonds32

About 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine

3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine (PubChem CID 158393903) has the molecular formula C109H112Cl6N26O8 and a molecular weight of 2126.99 g/mol. Its IUPAC name is 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine.

Molecular Properties

Compound Name3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine
PubChem CID158393903
Molecular FormulaC109H112Cl6N26O8
Molecular Weight2126.99 g/mol
Exact Mass2122.73
IUPAC Name3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine
SMILESC.C1COCCN1.O=C(CCc1ncn2ccc(Cl)cc12)c1cn[nH]c1.O=C(CCc1ncn2ccc(Cl)cc12)c1cnn(Cc2cn3cc(C4CC4)cc(CCl)c3n2)c1.O=C(CCc1ncn2ccc(Cl)cc12)c1cnn(Cc2cn3cc(C4CC4)cc(CN4CCOCC4)c3n2)c1.O=C(CCc1ncn2ccc(Cl)cc12)c1cnn(Cc2cn3cc(C4CC4)cc(CO)c3n2)c1.OCc1cc(C2CC2)cn2cc(CCl)nc12
InChIInChI=1S/C29H30ClN7O2.C25H22Cl2N6O.C25H23ClN6O2.C13H11ClN4O.C12H13ClN2O.C4H9NO.CH4/c30-24-5-6-35-19-31-26(27(35)12-24)3-4-28(38)23-13-32-37(16-23)18-25-17-36-15-21(20-1-2-20)11-22(29(36)33-25)14-34-7-9-39-10-8-34;26-9-17-7-18(16-1-2-16)11-32-13-21(30-25(17)32)14-33-12-19(10-29-33)24(34)4-3-22-23-8-20(27)5-6-31(23)15-28-22;26-20-5-6-30-15-27-22(23(30)8-20)3-4-24(34)19-9-28-32(11-19)13-21-12-31-10-17(16-1-2-16)7-18(14-33)25(31)29-21;14-10-3-4-18-8-15-11(12(18)5-10)1-2-13(19)9-6-16-17-7-9;13-4-11-6-15-5-9(8-1-2-8)3-10(7-16)12(15)14-11;1-3-6-4-2-5-1;/h5-6,11-13,15-17,19-20H,1-4,7-10,14,18H2;5-8,10-13,15-16H,1-4,9,14H2;5-12,15-16,33H,1-4,13-14H2;3-8H,1-2H2,(H,16,17);3,5-6,8,16H,1-2,4,7H2;5H,1-4H2;1H4
InChIKeyGXHOFBXRRIYQKG-UHFFFAOYSA-N
XLogP18.99
TPSA363.01 Ų
H-Bond Donors4
H-Bond Acceptors33
Rotatable Bonds32
Heavy Atoms149
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002126.99
LogP ≤ 518.99
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1033

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine?
The IUPAC name of 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine (CID 158393903) is 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine.
What is the SMILES notation for 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine?
The canonical SMILES for 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine is C.C1COCCN1.O=C(CCc1ncn2ccc(Cl)cc12)c1cn[nH]c1.O=C(CCc1ncn2ccc(Cl)cc12)c1cnn(Cc2cn3cc(C4CC4)cc(CCl)c3n2)c1.O=C(CCc1ncn2ccc(Cl)cc12)c1cnn(Cc2cn3cc(C4CC4)cc(CN4CCOCC4)c3n2)c1.O=C(CCc1ncn2ccc(Cl)cc12)c1cnn(Cc2cn3cc(C4CC4)cc(CO)c3n2)c1.OCc1cc(C2CC2)cn2cc(CCl)nc12.
What is the InChIKey of 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine?
The InChIKey is GXHOFBXRRIYQKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30ClN7O2.C25H22Cl2N6O.C25H23ClN6O2.C13H11ClN4O.C12H13ClN2O.C4H9NO.CH4/c30-24-5-6-35-19-31-26(27(35)12-24)3-4-28(38)23-13-32-37(16-23)18-25-17-36-15-21(20-1-2-20)11-22(29(36)33-25)14-34-7-9-39-10-8-34;26-9-17-7-18(16-1-2-16)11-32-13-21(30-25(17)32)14-33-12-19(10-29-33)24(34)4-3-22-23-8-20(27)5-6-31(23)15-28-22;26-20-5-6-30-15-27-22(23(30)8-20)3-4-24(34)19-9-28-32(11-19)13-21-12-31-10-17(16-1-2-16)7-18(14-33)25(31)29-21;14-10-3-4-18-8-15-11(12(18)5-10)1-2-13(19)9-6-16-17-7-9;13-4-11-6-15-5-9(8-1-2-8)3-10(7-16)12(15)14-11;1-3-6-4-2-5-1;/h5-6,11-13,15-17,19-20H,1-4,7-10,14,18H2;5-8,10-13,15-16H,1-4,9,14H2;5-12,15-16,33H,1-4,13-14H2;3-8H,1-2H2,(H,16,17);3,5-6,8,16H,1-2,4,7H2;5H,1-4H2;1H4.
What are the key properties of 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine?
3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine has a molecular weight of 2126.99 g/mol, XLogP of 18.99, 32 rotatable bonds, 4 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[8-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-[1-[[6-cyclopropyl-8-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-2-yl]methyl]pyrazol-4-yl]propan-1-one;3-(7-chloroimidazo[1,5-a]pyridin-1-yl)-1-(1H-pyrazol-4-yl)propan-1-one;[2-(chloromethyl)-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methanol;methane;morpholine is sourced from PubChem (CID 158393903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).