General Information of the Compound
| Compound ID |
CP0500240
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| Compound Name |
2-(3-(1-(isoquinolin-1-ylmethyl)piperidin-4-yl)-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)-N-methylacetamide
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| Structure |
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| Formula |
C25H27N5O2
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| Molecular Weight |
429.524
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| Canonical SMILES |
CNC(=O)Cn1c2ccccc2n(C2CCN(Cc3nccc4ccccc34)CC2)c1=O
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| InChI |
InChI=1S/C25H27N5O2/c1-26-24(31)17-29-22-8-4-5-9-23(22)30(25(29)32)19-11-14-28(15-12-19)16-21-20-7-3-2-6-18(20)10-13-27-21/h2-10,13,19H,11-12,14-17H2,1H3,(H,26,31)
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| InChIKey |
JTZDOEUJZWVVLB-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