N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide

C107H103F4N27O6S2 — CID 159932261

IUPACN-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide
SMILESC=CC(=O)Nc1cccc(C(F)(F)c2nc(Nc3ccc4nc(CN(C)C)ccc4c3)nc3[nH]ccc23)c1.C=CC(=O)Nc1cccc(C(F)(F)c2nc(Nc3ccc4nc(CN(C)C)ccc4c3)nc3nc[nH]c23)c1.C=CC(=O)Nc1cccc(Sc2nc(Nc3ccc4c(ccn4CCN(C)C)c3)ncc2OC)c1.C=CC(=O)Nc1cccc(Sc2nc(Nc3ccc4nc(CN(C)C)ccc4c3)ncc2OC)c1
InChIInChI=1S/C28H25F2N7O.C27H24F2N8O.C26H26N6O2S.C26H28N6O2S/c1-4-24(38)33-19-7-5-6-18(15-19)28(29,30)25-22-12-13-31-26(22)36-27(35-25)34-20-10-11-23-17(14-20)8-9-21(32-23)16-37(2)3;1-4-22(38)33-18-7-5-6-17(13-18)27(28,29)24-23-25(31-15-30-23)36-26(35-24)34-19-10-11-21-16(12-19)8-9-20(32-21)14-37(2)3;1-5-24(33)29-18-7-6-8-21(14-18)35-25-23(34-4)15-27-26(31-25)30-19-11-12-22-17(13-19)9-10-20(28-22)16-32(2)3;1-5-24(33)28-19-7-6-8-21(16-19)35-25-23(34-4)17-27-26(30-25)29-20-9-10-22-18(15-20)11-12-32(22)14-13-31(2)3/h4-15H,1,16H2,2-3H3,(H,33,38)(H2,31,34,35,36);4-13,15H,1,14H2,2-3H3,(H,33,38)(H2,30,31,34,35,36);5-15H,1,16H2,2-4H3,(H,29,33)(H,27,30,31);5-12,15-17H,1,13-14H2,2-4H3,(H,28,33)(H,27,29,30)
InChIKeyNZUFQUPPXVRXLO-UHFFFAOYSA-N
MW2003.31 g/mol
LogP20.68
Rot. Bonds35

About N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide

N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide (PubChem CID 159932261) has the molecular formula C107H103F4N27O6S2 and a molecular weight of 2003.31 g/mol. Its IUPAC name is N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide.

Molecular Properties

Compound NameN-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide
PubChem CID159932261
Molecular FormulaC107H103F4N27O6S2
Molecular Weight2003.31 g/mol
Exact Mass2001.80
IUPAC NameN-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide
SMILESC=CC(=O)Nc1cccc(C(F)(F)c2nc(Nc3ccc4nc(CN(C)C)ccc4c3)nc3[nH]ccc23)c1.C=CC(=O)Nc1cccc(C(F)(F)c2nc(Nc3ccc4nc(CN(C)C)ccc4c3)nc3nc[nH]c23)c1.C=CC(=O)Nc1cccc(Sc2nc(Nc3ccc4c(ccn4CCN(C)C)c3)ncc2OC)c1.C=CC(=O)Nc1cccc(Sc2nc(Nc3ccc4nc(CN(C)C)ccc4c3)ncc2OC)c1
InChIInChI=1S/C28H25F2N7O.C27H24F2N8O.C26H26N6O2S.C26H28N6O2S/c1-4-24(38)33-19-7-5-6-18(15-19)28(29,30)25-22-12-13-31-26(22)36-27(35-25)34-20-10-11-23-17(14-20)8-9-21(32-23)16-37(2)3;1-4-22(38)33-18-7-5-6-17(13-18)27(28,29)24-23-25(31-15-30-23)36-26(35-24)34-19-10-11-21-16(12-19)8-9-20(32-21)14-37(2)3;1-5-24(33)29-18-7-6-8-21(14-18)35-25-23(34-4)15-27-26(31-25)30-19-11-12-22-17(13-19)9-10-20(28-22)16-32(2)3;1-5-24(33)28-19-7-6-8-21(16-19)35-25-23(34-4)17-27-26(30-25)29-20-9-10-22-18(15-20)11-12-32(22)14-13-31(2)3/h4-15H,1,16H2,2-3H3,(H,33,38)(H2,31,34,35,36);4-13,15H,1,14H2,2-3H3,(H,33,38)(H2,30,31,34,35,36);5-15H,1,16H2,2-4H3,(H,29,33)(H,27,30,31);5-12,15-17H,1,13-14H2,2-4H3,(H,28,33)(H,27,29,30)
InChIKeyNZUFQUPPXVRXLO-UHFFFAOYSA-N
XLogP20.68
TPSA387.13 Ų
H-Bond Donors10
H-Bond Acceptors29
Rotatable Bonds35
Heavy Atoms146
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002003.31
LogP ≤ 520.68
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide with MolForge

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Related Compounds

N-[3-[[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide
CID 158991730
N-[3-[[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-7H-purin-6-yl]sulfanyl]phenyl]prop-2-enamide;N-[3-[[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]sulfanyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl]phenyl]prop-2-enamide
CID 157985353
N-[3-[[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[3-[[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-7H-purin-6-yl]amino]phenyl]prop-2-enamide;N-[3-[[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]phenyl]prop-2-enamide
CID 158647979
2-[5-[[4-(6-aminohexylamino)-6-fluoro-8-[[hydroxy(methyl)boranyl]-methylamino]-9H-pyrimido[4,5-b]indol-2-yl]oxy]pyrimidin-2-yl]sulfanylacetic acid;N-[4-benzylsulfanyl-6-fluoro-2-(2-methylsulfanylpyrimidin-5-yl)oxy-9H-pyrimido[4,5-b]indol-8-yl]-N-dimethylboronamidic acid;10-fluoro-8-(methylamino)-2-oxa-25-thia-4,6,15,22,27,30,31-heptazapentacyclo[24.2.2.13,14.05,13.07,12]hentriaconta-1(29),3,5(13),7(12),8,10,14(31),26(30),27-nonaen-23-one;N-(10-fluoro-23-oxo-2-oxa-25-thia-4,6,15,22,27,30,31-heptazapentacyclo[24.2.2.13,14.05,13.07,12]hentriaconta-1(29),3,5(13),7(12),8,10,14(31),26(30),27-nonaen-8-yl)-N-dimethylboronamidic acid
CID 159004897
N-[3-[[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[3-[[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-7H-purin-6-yl]amino]phenyl]prop-2-enamide;N-[3-[[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]amino]phenyl]prop-2-enamide
CID 160905281

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide?
The IUPAC name of N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide (CID 159932261) is N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide.
What is the SMILES notation for N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide?
The canonical SMILES for N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide is C=CC(=O)Nc1cccc(C(F)(F)c2nc(Nc3ccc4nc(CN(C)C)ccc4c3)nc3[nH]ccc23)c1.C=CC(=O)Nc1cccc(C(F)(F)c2nc(Nc3ccc4nc(CN(C)C)ccc4c3)nc3nc[nH]c23)c1.C=CC(=O)Nc1cccc(Sc2nc(Nc3ccc4c(ccn4CCN(C)C)c3)ncc2OC)c1.C=CC(=O)Nc1cccc(Sc2nc(Nc3ccc4nc(CN(C)C)ccc4c3)ncc2OC)c1.
What is the InChIKey of N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide?
The InChIKey is NZUFQUPPXVRXLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H25F2N7O.C27H24F2N8O.C26H26N6O2S.C26H28N6O2S/c1-4-24(38)33-19-7-5-6-18(15-19)28(29,30)25-22-12-13-31-26(22)36-27(35-25)34-20-10-11-23-17(14-20)8-9-21(32-23)16-37(2)3;1-4-22(38)33-18-7-5-6-17(13-18)27(28,29)24-23-25(31-15-30-23)36-26(35-24)34-19-10-11-21-16(12-19)8-9-20(32-21)14-37(2)3;1-5-24(33)29-18-7-6-8-21(14-18)35-25-23(34-4)15-27-26(31-25)30-19-11-12-22-17(13-19)9-10-20(28-22)16-32(2)3;1-5-24(33)28-19-7-6-8-21(16-19)35-25-23(34-4)17-27-26(30-25)29-20-9-10-22-18(15-20)11-12-32(22)14-13-31(2)3/h4-15H,1,16H2,2-3H3,(H,33,38)(H2,31,34,35,36);4-13,15H,1,14H2,2-3H3,(H,33,38)(H2,30,31,34,35,36);5-15H,1,16H2,2-4H3,(H,29,33)(H,27,30,31);5-12,15-17H,1,13-14H2,2-4H3,(H,28,33)(H,27,29,30).
What are the key properties of N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide?
N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide has a molecular weight of 2003.31 g/mol, XLogP of 20.68, 35 rotatable bonds, 10 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-[[1-[2-(dimethylamino)ethyl]indol-5-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-5-methoxypyrimidin-4-yl]sulfanylphenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-purin-6-yl]-difluoromethyl]phenyl]prop-2-enamide;N-[3-[[2-[[2-[(dimethylamino)methyl]quinolin-6-yl]amino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-difluoromethyl]phenyl]prop-2-enamide is sourced from PubChem (CID 159932261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).