(E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide

C122H106F3N12O11+ — CID 158486703

IUPAC(E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide
SMILESCN[C@H](Cc1ccccc1)C(=O)Nc1ccc(C)c(-c2ccc3ccncc3c2)c1.COc1cc(OC)cc(C(=O)Nc2ccc(C)c(-c3ccc4ccncc4c3)c2)c1.Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1-c1cccc(/C=C/C(=O)O)c1.Cc1ccc(NC(=O)c2cccc(OC(F)(F)F)c2)cc1-c1ccc2ccncc2c1.Cc1ccc(NC(=O)c2cccc[n+]2O)cc1-c1ccc2ccncc2c1
InChIInChI=1S/C26H25N3O.C25H22N2O3.C25H24N2O3.C24H17F3N2O2.C22H17N3O2/c1-18-8-11-23(29-26(30)25(27-2)14-19-6-4-3-5-7-19)16-24(18)21-10-9-20-12-13-28-17-22(20)15-21;1-16-4-7-21(27-25(28)19-11-22(29-2)14-23(12-19)30-3)13-24(16)18-6-5-17-8-9-26-15-20(17)10-18;1-17-10-12-21(26-25(30)20-8-5-9-22(15-20)27(2)3)16-23(17)19-7-4-6-18(14-19)11-13-24(28)29;1-15-5-8-20(13-22(15)17-7-6-16-9-10-28-14-19(16)11-17)29-23(30)18-3-2-4-21(12-18)31-24(25,26)27;1-15-5-8-19(24-22(26)21-4-2-3-11-25(21)27)13-20(15)17-7-6-16-9-10-23-14-18(16)12-17/h3-13,15-17,25,27H,14H2,1-2H3,(H,29,30);4-15H,1-3H3,(H,27,28);4-16H,1-3H3,(H,26,30)(H,28,29);2-14H,1H3,(H,29,30);2-14H,1H3,(H-,24,26,27)/p+1/b;;13-11+;;/t25-;;;;/m1..../s1
InChIKeyNXHWBXPXBIGATL-NWOPKRTPSA-O
MW1973.26 g/mol
LogP25.89
Rot. Bonds24

About (E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide

(E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide (PubChem CID 158486703) has the molecular formula C122H106F3N12O11+ and a molecular weight of 1973.26 g/mol. Its IUPAC name is (E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide.

Molecular Properties

Compound Name(E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide
PubChem CID158486703
Molecular FormulaC122H106F3N12O11+
Molecular Weight1973.26 g/mol
Exact Mass1971.81
IUPAC Name(E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide
SMILESCN[C@H](Cc1ccccc1)C(=O)Nc1ccc(C)c(-c2ccc3ccncc3c2)c1.COc1cc(OC)cc(C(=O)Nc2ccc(C)c(-c3ccc4ccncc4c3)c2)c1.Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1-c1cccc(/C=C/C(=O)O)c1.Cc1ccc(NC(=O)c2cccc(OC(F)(F)F)c2)cc1-c1ccc2ccncc2c1.Cc1ccc(NC(=O)c2cccc[n+]2O)cc1-c1ccc2ccncc2c1
InChIInChI=1S/C26H25N3O.C25H22N2O3.C25H24N2O3.C24H17F3N2O2.C22H17N3O2/c1-18-8-11-23(29-26(30)25(27-2)14-19-6-4-3-5-7-19)16-24(18)21-10-9-20-12-13-28-17-22(20)15-21;1-16-4-7-21(27-25(28)19-11-22(29-2)14-23(12-19)30-3)13-24(16)18-6-5-17-8-9-26-15-20(17)10-18;1-17-10-12-21(26-25(30)20-8-5-9-22(15-20)27(2)3)16-23(17)19-7-4-6-18(14-19)11-13-24(28)29;1-15-5-8-20(13-22(15)17-7-6-16-9-10-28-14-19(16)11-17)29-23(30)18-3-2-4-21(12-18)31-24(25,26)27;1-15-5-8-19(24-22(26)21-4-2-3-11-25(21)27)13-20(15)17-7-6-16-9-10-23-14-18(16)12-17/h3-13,15-17,25,27H,14H2,1-2H3,(H,29,30);4-15H,1-3H3,(H,27,28);4-16H,1-3H3,(H,26,30)(H,28,29);2-14H,1H3,(H,29,30);2-14H,1H3,(H-,24,26,27)/p+1/b;;13-11+;;/t25-;;;;/m1..../s1
InChIKeyNXHWBXPXBIGATL-NWOPKRTPSA-O
XLogP25.89
TPSA301.43 Ų
H-Bond Donors8
H-Bond Acceptors16
Rotatable Bonds24
Heavy Atoms148
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001973.26
LogP ≤ 525.89
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze (E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide with MolForge

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Related Compounds

US11116760, Example 121
CID 146566988
2-[[2,6-Difluoro-4-(1,1,1-trifluorobutan-2-ylamino)benzoyl]amino]-3-[8-[2,6-dimethoxy-4-(morpholin-4-ylmethyl)phenyl]quinolin-5-yl]propanoic acid
CID 146566992
CID 157073927
CID 157073927
methyl (2S)-2-[(2,6-difluorobenzoyl)amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]-6-fluoroquinolin-5-yl]propanoate;methyl (2S)-2-[(2,6-difluorobenzoyl)amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]-7-fluoroquinolin-5-yl]propanoate;methyl (2S)-2-[(2,6-difluorobenzoyl)amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]-2-(trifluoromethyl)quinolin-5-yl]propanoate;methyl (2S)-2-[(2,6-difluorobenzoyl)amino]-3-[8-[4-(ethoxymethyl)-2,6-dimethoxyphenyl]-3-(trifluoromethyl)quinolin-5-yl]propanoate
CID 158854364
carbon dioxide;1-(cyclohexylamino)-3-isoquinolin-6-ylpropan-2-one;1-[(3-fluorophenyl)methylamino]-3-isoquinolin-6-ylpropan-2-one;1-isoquinolin-6-yl-3-[(3-methoxyphenyl)methylamino]propan-2-one;1-isoquinolin-6-yl-3-[(4-methylphenyl)methylamino]propan-2-one;[3-[[(3-isoquinolin-6-yl-2-oxopropyl)amino]methyl]phenyl] acetate;(E)-1-isoquinolin-6-yl-4-[4-(1-phenylcyclopropanecarbonyl)phenyl]but-3-en-2-one;(E)-N-isoquinolin-6-yl-3-[4-(2-phenylprop-2-enoyl)phenyl]prop-2-enamide;1-isoquinolin-6-yl-3-[[3-(trifluoromethoxy)phenyl]methylamino]propan-2-one
CID 159344068
methyl (2S)-2-[[2,6-difluoro-4-[[(2R)-1,1,1-trifluorobutan-2-yl]amino]benzoyl]amino]-3-[8-[2,6-dimethoxy-3-methyl-4-(morpholin-4-ylmethyl)phenyl]quinolin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(2R)-1,1,1-trifluorobutan-2-yl]amino]benzoyl]amino]-3-[8-(1,4-dimethyl-6-oxopyridazin-3-yl)quinolin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(2R)-1,1,1-trifluorobutan-2-yl]amino]benzoyl]amino]-3-[8-(3-methoxy-6-methyl-2-pyridinyl)quinolin-5-yl]propanoate
CID 160734082
3-[[4-[4-[(4,4-difluoro-2,3-dihydro-1H-isoquinolin-5-yl)methyl]piperidin-1-yl]-3-fluorophenyl]methyl]piperidine-2,6-dione;2,6-dimethoxy-4-(2-methyl-1-oxo-2,7-naphthyridin-4-yl)benzoic acid;3-[4-[4-[[2-[2,6-dimethoxy-4-(2-methyl-1-oxo-2,7-naphthyridin-4-yl)benzoyl]-4,4-difluoro-1,3-dihydroisoquinolin-5-yl]methyl]piperidin-1-yl]-3-fluoroanilino]piperidine-2,6-dione
CID 165056774
(2S)-2-[[4-[[(2R)-4-[5-[(2S)-2-carboxy-2-[[2,6-difluoro-4-[[(2R)-1,1,1-trifluorobutan-2-yl]amino]benzoyl]amino]ethyl]-8-[2,6-dimethoxy-4-(morpholin-4-ylmethyl)phenyl]quinolin-2-yl]-1,1,1-trifluorobutan-2-yl]amino]-2,6-difluorobenzoyl]amino]-3-[8-[6-fluoro-1-methyl-2-oxo-4-(trifluoromethyl)quinolin-3-yl]quinolin-5-yl]propanoic acid
CID 162615956
N,N-diethyl-4-(6-fluorospiro[chromene-2,4'-piperidine]-4-yl)-3-hydroxybenzamide;N,N-diethyl-4-(6-fluorospiro[3,4-dihydrochromene-2,4'-piperidine]-4-yl)-3-hydroxybenzamide;N,N-diethyl-4-(7-fluorospiro[2,4-dihydro-1H-naphthalene-3,4'-piperidine]-1-yl)-3-hydroxybenzamide;N,N-diethyl-4-(7-fluorospiro[4H-naphthalene-3,4'-piperidine]-1-yl)-3-hydroxybenzamide;5-[5-(difluoromethoxy)spiro[chromene-2,4'-piperidine]-4-yl]-N,N-diethylpyridine-2-carboxamide;methane
CID 157065444
8-(2,6-difluoro-3,5-dimethoxyphenyl)-N-[6-[[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methyl]-3-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-difluoro-3,5-dimethoxyphenyl)-N-[6-(piperazin-1-ylmethyl)-3-pyridinyl]quinoxaline-5-carboxamide;8-(2,6-difluoro-3,5-dimethoxyphenyl)quinoxaline-5-carboxylic acid;methane;6-[[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]methyl]pyridin-3-amine
CID 160077300
4-cyano-N-(3-isoquinolin-7-yl-4-methylphenyl)benzamide;N-[3-(4-cyanophenyl)-4-methylphenyl]-3-(dimethylamino)benzamide;3-(dimethylamino)-N-[3-(3-isocyanophenyl)-4-methylphenyl]benzamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-methoxy-5-methylbenzamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-4-methylpiperazine-2-carboxamide
CID 160858618
N,N-diethyl-4-(6-fluorospiro[chromene-2,4'-piperidine]-4-yl)-3-hydroxybenzamide;N,N-diethyl-4-(6-fluorospiro[3,4-dihydrochromene-2,4'-piperidine]-4-yl)-3-hydroxybenzamide;N,N-diethyl-4-(7-fluorospiro[2,4-dihydro-1H-naphthalene-3,4'-piperidine]-1-yl)-3-hydroxybenzamide;N,N-diethyl-4-(7-fluorospiro[4H-naphthalene-3,4'-piperidine]-1-yl)-3-hydroxybenzamide;5-[5-(difluoromethoxy)spiro[chromene-2,4'-piperidine]-4-yl]-N,N-diethylpyridine-2-carboxamide
CID 161107768

Frequently Asked Questions

What is the IUPAC name of (E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide?
The IUPAC name of (E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide (CID 158486703) is (E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide.
What is the SMILES notation for (E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide?
The canonical SMILES for (E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide is CN[C@H](Cc1ccccc1)C(=O)Nc1ccc(C)c(-c2ccc3ccncc3c2)c1.COc1cc(OC)cc(C(=O)Nc2ccc(C)c(-c3ccc4ccncc4c3)c2)c1.Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1-c1cccc(/C=C/C(=O)O)c1.Cc1ccc(NC(=O)c2cccc(OC(F)(F)F)c2)cc1-c1ccc2ccncc2c1.Cc1ccc(NC(=O)c2cccc[n+]2O)cc1-c1ccc2ccncc2c1.
What is the InChIKey of (E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide?
The InChIKey is NXHWBXPXBIGATL-NWOPKRTPSA-O. The full InChI is InChI=1S/C26H25N3O.C25H22N2O3.C25H24N2O3.C24H17F3N2O2.C22H17N3O2/c1-18-8-11-23(29-26(30)25(27-2)14-19-6-4-3-5-7-19)16-24(18)21-10-9-20-12-13-28-17-22(20)15-21;1-16-4-7-21(27-25(28)19-11-22(29-2)14-23(12-19)30-3)13-24(16)18-6-5-17-8-9-26-15-20(17)10-18;1-17-10-12-21(26-25(30)20-8-5-9-22(15-20)27(2)3)16-23(17)19-7-4-6-18(14-19)11-13-24(28)29;1-15-5-8-20(13-22(15)17-7-6-16-9-10-28-14-19(16)11-17)29-23(30)18-3-2-4-21(12-18)31-24(25,26)27;1-15-5-8-19(24-22(26)21-4-2-3-11-25(21)27)13-20(15)17-7-6-16-9-10-23-14-18(16)12-17/h3-13,15-17,25,27H,14H2,1-2H3,(H,29,30);4-15H,1-3H3,(H,27,28);4-16H,1-3H3,(H,26,30)(H,28,29);2-14H,1H3,(H,29,30);2-14H,1H3,(H-,24,26,27)/p+1/b;;13-11+;;/t25-;;;;/m1..../s1.
What are the key properties of (E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide?
(E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide has a molecular weight of 1973.26 g/mol, XLogP of 25.89, 24 rotatable bonds, 8 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-[3-[5-[[3-(dimethylamino)benzoyl]amino]-2-methylphenyl]phenyl]prop-2-enoic acid;1-hydroxy-N-(3-isoquinolin-7-yl-4-methylphenyl)pyridin-1-ium-2-carboxamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3,5-dimethoxybenzamide;(2R)-N-(3-isoquinolin-7-yl-4-methylphenyl)-2-(methylamino)-3-phenylpropanamide;N-(3-isoquinolin-7-yl-4-methylphenyl)-3-(trifluoromethoxy)benzamide is sourced from PubChem (CID 158486703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).