General Information of the Compound
| Compound ID |
CP0633679
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| Compound Name |
N-(5-Methyl-pyrazin-2-ylmethyl)-3-(5-methyl-pyridin-2-yl)-5-(2-oxo-2,3-dihydro-indol-1-yl)-benzamide
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| Structure |
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| Formula |
C27H23N5O2
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| Molecular Weight |
449.514
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| Canonical SMILES |
Cc1ccc(-c2cc(C(=O)NCc3cnc(C)cn3)cc(N3C(=O)Cc4ccccc43)c2)nc1
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| InChI |
InChI=1S/C27H23N5O2/c1-17-7-8-24(30-13-17)20-9-21(27(34)31-16-22-15-28-18(2)14-29-22)11-23(10-20)32-25-6-4-3-5-19(25)12-26(32)33/h3-11,13-15H,12,16H2,1-2H3,(H,31,34)
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| InChIKey |
SNULHIJATIOARQ-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