General Information of the Compound
| Compound ID |
CP0910828
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| Compound Name |
N-(3-chlorobenzyl)-6-nitro-9H-pyrido[2,3-b]indol-4-amine
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| Structure |
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| Formula |
C18H13ClN4O2
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| Molecular Weight |
352.781
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| Canonical SMILES |
O=[N+]([O-])c1ccc2[nH]c3nccc(NCc4cccc(Cl)c4)c3c2c1
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| InChI |
InChI=1S/C18H13ClN4O2/c19-12-3-1-2-11(8-12)10-21-16-6-7-20-18-17(16)14-9-13(23(24)25)4-5-15(14)22-18/h1-9H,10H2,(H2,20,21,22)
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| InChIKey |
VCDSHKSQYBUJEG-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
Protein ID: PT00922, Epidermal growth factor receptor
Protein ID: PT01104, Insulin-like growth factor 1 receptor