General Information of the Compound
| Compound ID |
CP0251247
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| Compound Name |
2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]acetamide
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| Structure |
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| Formula |
C29H26ClN3O4
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| Molecular Weight |
515.997
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| Canonical SMILES |
COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(=O)NCCc3c[nH]c4ccc(O)cc34)c2c1
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| InChI |
InChI=1S/C29H26ClN3O4/c1-17-23(15-28(35)31-12-11-19-16-32-26-9-7-21(34)13-24(19)26)25-14-22(37-2)8-10-27(25)33(17)29(36)18-3-5-20(30)6-4-18/h3-10,13-14,16,32,34H,11-12,15H2,1-2H3,(H,31,35)
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| InChIKey |
UQXDHCCSBGHKLS-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