General Information of the Compound
| Compound ID |
CP0453078
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| Compound Name |
N-[3-(4-chlorophenyl)propyl]-4-[2-(dimethylamino)ethyl]-1H-indole-2-carboxamide
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| Structure |
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| Formula |
C22H26ClN3O
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| Molecular Weight |
383.923
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| Canonical SMILES |
CN(C)CCc1cccc2[nH]c(cc12)C(=O)NCCCc1ccc(Cl)cc1
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| InChI |
InChI=1S/C22H26ClN3O/c1-26(2)14-12-17-6-3-7-20-19(17)15-21(25-20)22(27)24-13-4-5-16-8-10-18(23)11-9-16/h3,6-11,15,25H,4-5,12-14H2,1-2H3,(H,24,27)
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| InChIKey |
GPONDRWNQDFWHT-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