General Information of the Compound
| Compound ID |
CP0576291
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| Compound Name |
N-(3-propan-2-ylphenyl)-3-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]propanamide
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| Structure |
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| Formula |
C25H25N3O
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| Molecular Weight |
383.495
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| Canonical SMILES |
CC(C)c1cccc(NC(=O)CCc2cccc(c2)-c2cnc3[nH]ccc3c2)c1
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| InChI |
InChI=1S/C25H25N3O/c1-17(2)19-6-4-8-23(15-19)28-24(29)10-9-18-5-3-7-20(13-18)22-14-21-11-12-26-25(21)27-16-22/h3-8,11-17H,9-10H2,1-2H3,(H,26,27)(H,28,29)
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| InChIKey |
ONYCJILVRZEEQY-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