3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide

C117H85F7N16O8S — CID 159025990

IUPAC3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NCc2cc(F)c3n[nH]c(-c4ccc5ccccc5c4)c3c2)c1.COc1ccccc1C(=O)NCc1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.CS(=O)(=O)Nc1cc(F)c2n[nH]c(-c3cccc(F)c3)c2c1.N#Cc1cccc(C(=O)NCc2cc(F)c3n[nH]c(-c4ccc5ccccc5c4)c3c2)c1.O=C(NCc1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1)c1cccc(F)c1
InChIInChI=1S/C26H17FN4O.2C26H20FN3O2.C25H17F2N3O.C14H11F2N3O2S/c27-23-12-17(15-29-26(32)21-7-3-4-16(10-21)14-28)11-22-24(30-31-25(22)23)20-9-8-18-5-1-2-6-19(18)13-20;1-32-23-9-5-4-8-20(23)26(31)28-15-16-12-21-24(29-30-25(21)22(27)13-16)19-11-10-17-6-2-3-7-18(17)14-19;1-32-21-8-4-7-20(14-21)26(31)28-15-16-11-22-24(29-30-25(22)23(27)12-16)19-10-9-17-5-2-3-6-18(17)13-19;26-20-7-3-6-19(13-20)25(31)28-14-15-10-21-23(29-30-24(21)22(27)11-15)18-9-8-16-4-1-2-5-17(16)12-18;1-22(20,21)19-10-6-11-13(8-3-2-4-9(15)5-8)17-18-14(11)12(16)7-10/h1-13H,15H2,(H,29,32)(H,30,31);2*2-14H,15H2,1H3,(H,28,31)(H,29,30);1-13H,14H2,(H,28,31)(H,29,30);2-7,19H,1H3,(H,17,18)
InChIKeyJUHCRAJCZRJQMH-UHFFFAOYSA-N
MW2008.12 g/mol
LogP24.72
Rot. Bonds21

About 3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide

3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide (PubChem CID 159025990) has the molecular formula C117H85F7N16O8S and a molecular weight of 2008.12 g/mol. Its IUPAC name is 3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide.

Molecular Properties

Compound Name3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide
PubChem CID159025990
Molecular FormulaC117H85F7N16O8S
Molecular Weight2008.12 g/mol
Exact Mass2006.63
IUPAC Name3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NCc2cc(F)c3n[nH]c(-c4ccc5ccccc5c4)c3c2)c1.COc1ccccc1C(=O)NCc1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.CS(=O)(=O)Nc1cc(F)c2n[nH]c(-c3cccc(F)c3)c2c1.N#Cc1cccc(C(=O)NCc2cc(F)c3n[nH]c(-c4ccc5ccccc5c4)c3c2)c1.O=C(NCc1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1)c1cccc(F)c1
InChIInChI=1S/C26H17FN4O.2C26H20FN3O2.C25H17F2N3O.C14H11F2N3O2S/c27-23-12-17(15-29-26(32)21-7-3-4-16(10-21)14-28)11-22-24(30-31-25(22)23)20-9-8-18-5-1-2-6-19(18)13-20;1-32-23-9-5-4-8-20(23)26(31)28-15-16-12-21-24(29-30-25(21)22(27)13-16)19-11-10-17-6-2-3-7-18(17)14-19;1-32-21-8-4-7-20(14-21)26(31)28-15-16-11-22-24(29-30-25(22)23(27)12-16)19-10-9-17-5-2-3-6-18(17)13-19;26-20-7-3-6-19(13-20)25(31)28-14-15-10-21-23(29-30-24(21)22(27)11-15)18-9-8-16-4-1-2-5-17(16)12-18;1-22(20,21)19-10-6-11-13(8-3-2-4-9(15)5-8)17-18-14(11)12(16)7-10/h1-13H,15H2,(H,29,32)(H,30,31);2*2-14H,15H2,1H3,(H,28,31)(H,29,30);1-13H,14H2,(H,28,31)(H,29,30);2-7,19H,1H3,(H,17,18)
InChIKeyJUHCRAJCZRJQMH-UHFFFAOYSA-N
XLogP24.72
TPSA348.22 Ų
H-Bond Donors10
H-Bond Acceptors14
Rotatable Bonds21
Heavy Atoms149
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002008.12
LogP ≤ 524.72
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1014

Analyze 3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide with MolForge

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Related Compounds

N-cyclopropyl-6-fluoro-3-(3-fluorophenyl)-1H-indazole-5-carboxamide;4-fluoro-3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-5-carboxamide;6-fluoro-3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-5-carboxamide;3-(3-fluorophenyl)-4-methoxy-N-[(3-methoxyphenyl)methyl]-2H-indazole-5-carboxamide;3-(3-fluorophenyl)-4-methoxy-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2H-indazole-5-carboxamide;3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-6-methyl-1H-indazole-5-carboxamide
CID 158034769
3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide
CID 160152264
N-[[3-(1-benzothiophen-2-yl)-6-fluoro-1H-indazol-5-yl]methyl]-2-methoxybenzamide;N-[[3-(1-benzothiophen-2-yl)-6-fluoro-1H-indazol-5-yl]methyl]-3-methoxybenzamide;N-[(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(6-fluoro-3-naphthalen-2-yl-1H-indazol-5-yl)methyl]-3-methoxybenzamide;N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanesulfonamide
CID 160656644
N-(cyanomethyl)-3-[(E)-2-(3-fluoro-4-methoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyanomethyl)-3-[(E)-2-(4-fluoro-3-methoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(2,3-dihydro-1-benzofuran-5-yl)ethenyl]-4-methoxy-N-prop-2-enyl-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluoro-4-methoxyphenyl)ethenyl]-4-methoxy-N-prop-2-enyl-2H-indazole-5-carboxamide;3-[(E)-2-(4-fluoro-3-methoxyphenyl)ethenyl]-4-methoxy-N-prop-2-enyl-2H-indazole-5-carboxamide
CID 160696488
N-(cyanomethyl)-3-[(E)-2-(3,4-difluorophenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;N-(cyanomethyl)-3-[(E)-2-(3-fluoro-4-methoxyphenyl)ethenyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(3,4-difluorophenyl)ethenyl]-4-methoxy-N-prop-2-enyl-2H-indazole-5-carboxamide;3-[(E)-2-(3-fluoro-4-methoxyphenyl)ethenyl]-4-methoxy-N-prop-2-enyl-2H-indazole-5-carboxamide;3-[(E)-2-(4-fluoro-3-methoxyphenyl)ethenyl]-4-methoxy-N-prop-2-enyl-2H-indazole-5-carboxamide
CID 161008489
N-[[3-(1-benzothiophen-2-yl)-6-fluoro-1H-indazol-5-yl]methyl]-2-methoxybenzamide;N-[[3-(1-benzothiophen-2-yl)-6-fluoro-1H-indazol-5-yl]methyl]-3-methoxybenzamide;N-[4-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methanesulfonamide;N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanesulfonamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]methanesulfonamide;N-[3-(3-fluorophenyl)-7-methyl-2H-indazol-5-yl]methanesulfonamide
CID 161528251
6-fluoro-3-(3-fluorophenyl)-4-methoxy-N-[(3-methoxyphenyl)methyl]-2H-indazole-5-carboxamide;4-fluoro-3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-5-carboxamide;3-(3-fluorophenyl)-4-methoxy-N-[(3-methoxyphenyl)methyl]-2H-indazole-5-carboxamide;3-(3-fluorophenyl)-4-methoxy-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2H-indazole-5-carboxamide;3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-6-methyl-1H-indazole-5-carboxamide;3-(3-fluorophenyl)-6-methyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1H-indazole-5-carboxamide
CID 161690788
4-(3-amino-4-methylphenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-propoxybenzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-propoxybenzamide;4-(4-fluoro-3-propanoylphenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-propoxybenzamide;N-(1H-indazol-7-ylmethyl)-4-(3-isocyanophenyl)-N-methyl-3-propoxybenzamide;N-(1H-indazol-7-ylmethyl)-N-methyl-4-[3-(methylcarbamoyl)phenyl]-3-propoxybenzamide;N-(1H-indazol-7-ylmethyl)-N-methyl-4-(3-methylphenyl)-3-propoxybenzamide;7-[[methyl-[3-propoxy-4-[3-(sulfinatoamino)phenyl]benzoyl]amino]methyl]-1H-indazole
CID 167588608
4-(3-amino-4-methylphenyl)-3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methylbenzamide;3-ethoxy-4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylbenzamide;3-ethoxy-4-(4-fluoro-3-propanoylphenyl)-N-(1H-indazol-7-ylmethyl)-N-methylbenzamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-4-(3-isocyanophenyl)-N-methylbenzamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(3-methylphenyl)benzamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(3-propanoylphenyl)benzamide;7-[[[3-ethoxy-4-[3-(sulfinatoamino)phenyl]benzoyl]-methylamino]methyl]-1H-indazole
CID 167604113

Frequently Asked Questions

What is the IUPAC name of 3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide?
The IUPAC name of 3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide (CID 159025990) is 3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide.
What is the SMILES notation for 3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide?
The canonical SMILES for 3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide is COc1cccc(C(=O)NCc2cc(F)c3n[nH]c(-c4ccc5ccccc5c4)c3c2)c1.COc1ccccc1C(=O)NCc1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1.CS(=O)(=O)Nc1cc(F)c2n[nH]c(-c3cccc(F)c3)c2c1.N#Cc1cccc(C(=O)NCc2cc(F)c3n[nH]c(-c4ccc5ccccc5c4)c3c2)c1.O=C(NCc1cc(F)c2n[nH]c(-c3ccc4ccccc4c3)c2c1)c1cccc(F)c1.
What is the InChIKey of 3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide?
The InChIKey is JUHCRAJCZRJQMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H17FN4O.2C26H20FN3O2.C25H17F2N3O.C14H11F2N3O2S/c27-23-12-17(15-29-26(32)21-7-3-4-16(10-21)14-28)11-22-24(30-31-25(22)23)20-9-8-18-5-1-2-6-19(18)13-20;1-32-23-9-5-4-8-20(23)26(31)28-15-16-12-21-24(29-30-25(21)22(27)13-16)19-11-10-17-6-2-3-7-18(17)14-19;1-32-21-8-4-7-20(14-21)26(31)28-15-16-11-22-24(29-30-25(22)23(27)12-16)19-10-9-17-5-2-3-6-18(17)13-19;26-20-7-3-6-19(13-20)25(31)28-14-15-10-21-23(29-30-24(21)22(27)11-15)18-9-8-16-4-1-2-5-17(16)12-18;1-22(20,21)19-10-6-11-13(8-3-2-4-9(15)5-8)17-18-14(11)12(16)7-10/h1-13H,15H2,(H,29,32)(H,30,31);2*2-14H,15H2,1H3,(H,28,31)(H,29,30);1-13H,14H2,(H,28,31)(H,29,30);2-7,19H,1H3,(H,17,18).
What are the key properties of 3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide?
3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide has a molecular weight of 2008.12 g/mol, XLogP of 24.72, 21 rotatable bonds, 10 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyano-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;3-fluoro-N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]benzamide;N-[7-fluoro-3-(3-fluorophenyl)-2H-indazol-5-yl]methanesulfonamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-2-methoxybenzamide;N-[(7-fluoro-3-naphthalen-2-yl-2H-indazol-5-yl)methyl]-3-methoxybenzamide is sourced from PubChem (CID 159025990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).