1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one

C100H82F2N28O6 — CID 157179458

IUPAC1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one
SMILESCc1cn2c(-c3ccc4c(c3)C(CN)=NCC4=O)cnc2cn1.Cc1nc2cnccn2c1-c1ccc2c(c1)C(CN)=NCC2=O.NCC1=NCC(=O)c2ccc(-c3cnc4c(F)cccn34)cc21.NCC1=NCC(=O)c2ccc(-c3cnc4ccc(F)cn34)cc21.NCC1=NCC(=O)c2ccc(-c3cnc4cccnn34)cc21.NCC1=NCC(=O)c2ccc(-c3cnc4cnccn34)cc21
InChIInChI=1S/2C17H13FN4O.2C17H15N5O.2C16H13N5O/c18-11-2-4-17-21-7-15(22(17)9-11)10-1-3-12-13(5-10)14(6-19)20-8-16(12)23;18-13-2-1-5-22-15(8-21-17(13)22)10-3-4-11-12(6-10)14(7-19)20-9-16(11)23;1-10-9-22-15(6-21-17(22)8-19-10)11-2-3-12-13(4-11)14(5-18)20-7-16(12)23;1-10-17(22-5-4-19-9-16(22)21-10)11-2-3-12-13(6-11)14(7-18)20-8-15(12)23;17-6-13-12-5-10(1-2-11(12)15(22)8-19-13)14-7-20-16-9-18-3-4-21(14)16;17-7-13-12-6-10(3-4-11(12)15(22)9-18-13)14-8-19-16-2-1-5-20-21(14)16/h1-5,7,9H,6,8,19H2;1-6,8H,7,9,19H2;2-4,6,8-9H,5,7,18H2,1H3;2-6,9H,7-8,18H2,1H3;1-5,7,9H,6,8,17H2;1-6,8H,7,9,17H2
InChIKeyAOJZQYNMGNOEEH-UHFFFAOYSA-N
MW1809.94 g/mol
LogP10.15
Rot. Bonds12

About 1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one

1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one (PubChem CID 157179458) has the molecular formula C100H82F2N28O6 and a molecular weight of 1809.94 g/mol. Its IUPAC name is 1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one.

Molecular Properties

Compound Name1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one
PubChem CID157179458
Molecular FormulaC100H82F2N28O6
Molecular Weight1809.94 g/mol
Exact Mass1808.69
IUPAC Name1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one
SMILESCc1cn2c(-c3ccc4c(c3)C(CN)=NCC4=O)cnc2cn1.Cc1nc2cnccn2c1-c1ccc2c(c1)C(CN)=NCC2=O.NCC1=NCC(=O)c2ccc(-c3cnc4c(F)cccn34)cc21.NCC1=NCC(=O)c2ccc(-c3cnc4ccc(F)cn34)cc21.NCC1=NCC(=O)c2ccc(-c3cnc4cccnn34)cc21.NCC1=NCC(=O)c2ccc(-c3cnc4cnccn34)cc21
InChIInChI=1S/2C17H13FN4O.2C17H15N5O.2C16H13N5O/c18-11-2-4-17-21-7-15(22(17)9-11)10-1-3-12-13(5-10)14(6-19)20-8-16(12)23;18-13-2-1-5-22-15(8-21-17(13)22)10-3-4-11-12(6-10)14(7-19)20-9-16(11)23;1-10-9-22-15(6-21-17(22)8-19-10)11-2-3-12-13(4-11)14(5-18)20-7-16(12)23;1-10-17(22-5-4-19-9-16(22)21-10)11-2-3-12-13(6-11)14(7-18)20-8-15(12)23;17-6-13-12-5-10(1-2-11(12)15(22)8-19-13)14-7-20-16-9-18-3-4-21(14)16;17-7-13-12-6-10(3-4-11(12)15(22)9-18-13)14-8-19-16-2-1-5-20-21(14)16/h1-5,7,9H,6,8,19H2;1-6,8H,7,9,19H2;2-4,6,8-9H,5,7,18H2,1H3;2-6,9H,7-8,18H2,1H3;1-5,7,9H,6,8,17H2;1-6,8H,7,9,17H2
InChIKeyAOJZQYNMGNOEEH-UHFFFAOYSA-N
XLogP10.15
TPSA488.06 Ų
H-Bond Donors6
H-Bond Acceptors34
Rotatable Bonds12
Heavy Atoms136
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001809.94
LogP ≤ 510.15
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1034

Analyze 1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one with MolForge

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Related Compounds

N-[4-[[(3R)-3-(dimethylamino)pyrrolidin-1-yl]methyl]-3-(trifluoromethyl)phenyl]-3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzamide
CID 88996442
7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(2-fluoro-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 90758816
7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(4-fluorophenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(2-fluoro-4-pyridinyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(2-isocyano-4-pyridinyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[3-(trifluoromethyl)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[4-(trifluoromethyl)phenyl]methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 90773520
7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-3-fluoro-5-N-[(2-fluoro-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-3-fluoro-5-N-[(2-isocyano-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-3-fluoro-5-N-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 91095611
7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(4-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(2-fluoro-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(2-isocyano-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-4-methyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 91467421
7-N-[(1S)-5-acetyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(2-fluoro-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-2,3-dihydro-1H-inden-1-yl]-5-N-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(1S)-5-acetyl-2,3-dihydro-1H-inden-1-yl]-5-N-[(2-isocyano-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 91495532
3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-N-[4-[[4-[7-[4-[[4-[[3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoyl]amino]-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-3,5-dioxoheptyl]piperazin-1-yl]methyl]-3-(trifluoromethyl)phenyl]-4-methylbenzamide
CID 126550922
3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-N-[4-[[4-[[4-[[4-[[3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoyl]amino]-2-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]piperazin-1-yl]methyl]-3-(trifluoromethyl)phenyl]-4-methylbenzamide
CID 134501876
N-[3-[5-[6-[4-[4-amino-3-[2-cyano-5-[6-[4-(4-piperidin-4-ylpiperazine-1-carbonyl)phenyl]imidazo[1,2-a]pyridin-3-yl]phenyl]piperidine-1-carbonyl]phenyl]imidazo[1,2-a]pyridin-3-yl]-2-cyanophenyl]-1-[4-[(3Z)-4-[5-(4-cyanophenyl)-1-methylimidazol-2-yl]buta-1,3-dien-2-yl]benzoyl]piperidin-4-yl]-2,2,2-trifluoroacetamide
CID 134505018
5-[1-(3,3-difluoro-2,2-dimethylpropyl)pyrazol-4-yl]-6-[7-[3-[4-[2-[2-[2-[4-[5-fluoro-4-(2-imidazo[1,2-a]pyridin-7-yl-6-methylpyridin-3-yl)pyrazol-1-yl]-2-methylbutyl]cyclopropyl]-3-oxo-1H-isoindol-5-yl]-6-methylpyridin-3-yl]pyrazol-1-yl]-2-methylpropyl]-2-methyl-3-oxo-1H-isoindol-5-yl]pyridine-2-carbonitrile
CID 137390007
N-[5-[7-[2-fluoro-5-[5-methyl-2-[5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-3-yl]-3,4-dihydrocyclohepta[d]imidazol-8-yl]phenyl]-3-[7-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-2-yl]-1H-pyrazolo[4,3-b]pyridin-5-yl]-3-pyridinyl]benzamide
CID 145252871
2-(2,6-dioxopiperidin-3-yl)-5-[(E)-3-[4-[6-[6-[2-(3-fluorophenyl)pyrrolidin-1-yl]imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]piperazin-1-yl]-3-oxoprop-1-enyl]isoindole-1,3-dione
CID 146410304

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one?
The IUPAC name of 1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one (CID 157179458) is 1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one.
What is the SMILES notation for 1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one?
The canonical SMILES for 1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one is Cc1cn2c(-c3ccc4c(c3)C(CN)=NCC4=O)cnc2cn1.Cc1nc2cnccn2c1-c1ccc2c(c1)C(CN)=NCC2=O.NCC1=NCC(=O)c2ccc(-c3cnc4c(F)cccn34)cc21.NCC1=NCC(=O)c2ccc(-c3cnc4ccc(F)cn34)cc21.NCC1=NCC(=O)c2ccc(-c3cnc4cccnn34)cc21.NCC1=NCC(=O)c2ccc(-c3cnc4cnccn34)cc21.
What is the InChIKey of 1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one?
The InChIKey is AOJZQYNMGNOEEH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C17H13FN4O.2C17H15N5O.2C16H13N5O/c18-11-2-4-17-21-7-15(22(17)9-11)10-1-3-12-13(5-10)14(6-19)20-8-16(12)23;18-13-2-1-5-22-15(8-21-17(13)22)10-3-4-11-12(6-10)14(7-19)20-9-16(11)23;1-10-9-22-15(6-21-17(22)8-19-10)11-2-3-12-13(4-11)14(5-18)20-7-16(12)23;1-10-17(22-5-4-19-9-16(22)21-10)11-2-3-12-13(6-11)14(7-18)20-8-15(12)23;17-6-13-12-5-10(1-2-11(12)15(22)8-19-13)14-7-20-16-9-18-3-4-21(14)16;17-7-13-12-6-10(3-4-11(12)15(22)9-18-13)14-8-19-16-2-1-5-20-21(14)16/h1-5,7,9H,6,8,19H2;1-6,8H,7,9,19H2;2-4,6,8-9H,5,7,18H2,1H3;2-6,9H,7-8,18H2,1H3;1-5,7,9H,6,8,17H2;1-6,8H,7,9,17H2.
What are the key properties of 1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one?
1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one has a molecular weight of 1809.94 g/mol, XLogP of 10.15, 12 rotatable bonds, 6 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-7-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(8-fluoroimidazo[1,2-a]pyridin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-a]pyrazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-imidazo[1,2-b]pyridazin-3-yl-3H-isoquinolin-4-one;1-(aminomethyl)-7-(2-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one;1-(aminomethyl)-7-(6-methylimidazo[1,2-a]pyrazin-3-yl)-3H-isoquinolin-4-one is sourced from PubChem (CID 157179458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).