General Information of the Compound
| Compound ID |
CP0431253
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| Compound Name |
3-methoxy-N-[[2-(4-methylpiperazin-1-yl)-1,3-dihydroinden-2-yl]methyl]benzamide
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| Structure |
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| Formula |
C23H29N3O2
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| Molecular Weight |
379.504
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| Canonical SMILES |
COc1cccc(c1)C(=O)NCC1(Cc2ccccc2C1)N1CCN(C)CC1
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| InChI |
InChI=1S/C23H29N3O2/c1-25-10-12-26(13-11-25)23(15-19-6-3-4-7-20(19)16-23)17-24-22(27)18-8-5-9-21(14-18)28-2/h3-9,14H,10-13,15-17H2,1-2H3,(H,24,27)
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| InChIKey |
HLSOWFUGZKHDKS-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