General Information of the Compound
| Compound ID |
CP0453535
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| Compound Name |
N-(6-chloro-9H-pyrido[3,4-b]indol-8-yl)-2-pyridin-2-ylacetamide
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| Structure |
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| Formula |
C18H13ClN4O
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| Molecular Weight |
336.782
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| Canonical SMILES |
Clc1cc(NC(=O)Cc2ccccn2)c2[nH]c3cnccc3c2c1
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| InChI |
InChI=1S/C18H13ClN4O/c19-11-7-14-13-4-6-20-10-16(13)23-18(14)15(8-11)22-17(24)9-12-3-1-2-5-21-12/h1-8,10,23H,9H2,(H,22,24)
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| InChIKey |
KNFPDDQBEKGJKM-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