General Information of the Compound
| Compound ID |
CP0496973
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| Compound Name |
3-[2-(2-Methoxy-phenyl)-5-methyl-1H-indol-3-yl]-1-[4-(2-methoxy-phenyl)-piperazin-1-yl]-propan-1-one
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| Structure |
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| Formula |
C30H33N3O3
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| Molecular Weight |
483.612
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| Canonical SMILES |
COc1ccccc1N1CCN(CC1)C(=O)CCc1c([nH]c2ccc(C)cc12)-c1ccccc1OC
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| InChI |
InChI=1S/C30H33N3O3/c1-21-12-14-25-24(20-21)22(30(31-25)23-8-4-6-10-27(23)35-2)13-15-29(34)33-18-16-32(17-19-33)26-9-5-7-11-28(26)36-3/h4-12,14,20,31H,13,15-19H2,1-3H3
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| InChIKey |
CMVXFHWNHDMDCR-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