General Information of the Compound
| Compound ID |
CP0562251
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| Compound Name |
N-(7-cyano-9H-pyrido[3,4-b]indol-1-yl)cyclopropanecarboxamide
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| Formula |
C16H12N4O
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| Molecular Weight |
276.299
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| Canonical SMILES |
O=C(Nc1nccc2c3ccc(cc3[nH]c12)C#N)C1CC1
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| InChI |
InChI=1S/C16H12N4O/c17-8-9-1-4-11-12-5-6-18-15(14(12)19-13(11)7-9)20-16(21)10-2-3-10/h1,4-7,10,19H,2-3H2,(H,18,20,21)
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| InChIKey |
LCSSVRYMQCYXOP-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