General Information of the Compound
| Compound ID |
CP0456149
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| Compound Name |
N-[[4-[[3-(dimethylcarbamoyl)phenyl]methoxy]phenyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide
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| Structure |
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| Formula |
C25H24N4O3
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| Molecular Weight |
428.492
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| Canonical SMILES |
CN(C)C(=O)c1cccc(COc2ccc(CNC(=O)c3cc4cnccc4[nH]3)cc2)c1
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| InChI |
InChI=1S/C25H24N4O3/c1-29(2)25(31)19-5-3-4-18(12-19)16-32-21-8-6-17(7-9-21)14-27-24(30)23-13-20-15-26-11-10-22(20)28-23/h3-13,15,28H,14,16H2,1-2H3,(H,27,30)
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| InChIKey |
HVZNSUOYEMWTPR-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