General Information of the Compound
| Compound ID |
CP0561787
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| Compound Name |
N-[(1-methylindol-5-yl)methyl]-3-[(4-methylphenoxy)methyl]pyrrolidine-1-carboxamide
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| Structure |
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| Formula |
C23H27N3O2
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| Molecular Weight |
377.488
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| Canonical SMILES |
Cc1ccc(OCC2CCN(C2)C(=O)NCc2ccc3n(C)ccc3c2)cc1
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| InChI |
InChI=1S/C23H27N3O2/c1-17-3-6-21(7-4-17)28-16-19-9-12-26(15-19)23(27)24-14-18-5-8-22-20(13-18)10-11-25(22)2/h3-8,10-11,13,19H,9,12,14-16H2,1-2H3,(H,24,27)
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| InChIKey |
IMHSYXIWPKSCBK-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