General Information of the Compound
| Compound ID |
CP0430859
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| Compound Name |
N'-(3-pyridin-2-ylisoquinolin-1-yl)benzenecarboximidamide
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| Structure |
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| Formula |
C21H16N4
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| Molecular Weight |
324.387
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| Canonical SMILES |
NC(=Nc1nc(cc2ccccc12)-c1ccccn1)c1ccccc1
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| InChI |
InChI=1S/C21H16N4/c22-20(15-8-2-1-3-9-15)25-21-17-11-5-4-10-16(17)14-19(24-21)18-12-6-7-13-23-18/h1-14H,(H2,22,24,25)
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| InChIKey |
KGSHAJBYUHHTJW-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound