General Information of the Compound
| Compound ID |
CP0383426
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| Compound Name |
N-[2-(4-aminophenyl)ethyl]-5-chloro-1H-indole-2-carboxamide
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| Structure |
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| Formula |
C17H16ClN3O
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| Molecular Weight |
313.788
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| Canonical SMILES |
Nc1ccc(CCNC(=O)c2cc3cc(Cl)ccc3[nH]2)cc1
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| InChI |
InChI=1S/C17H16ClN3O/c18-13-3-6-15-12(9-13)10-16(21-15)17(22)20-8-7-11-1-4-14(19)5-2-11/h1-6,9-10,21H,7-8,19H2,(H,20,22)
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| InChIKey |
FWWKVNVJDHDHCS-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: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2