General Information of the Compound
| Compound ID |
CP0497525
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| Compound Name |
4-[2-(5-chloro-2-phenylmethoxyphenyl)-5-methylpyrrol-1-yl]-N-[(1S)-1-phenylethyl]benzamide
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| Structure |
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| Formula |
C33H29ClN2O2
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| Molecular Weight |
521.06
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| Canonical SMILES |
C[C@H](NC(=O)c1ccc(cc1)-n1c(C)ccc1-c1cc(Cl)ccc1OCc1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C33H29ClN2O2/c1-23-13-19-31(30-21-28(34)16-20-32(30)38-22-25-9-5-3-6-10-25)36(23)29-17-14-27(15-18-29)33(37)35-24(2)26-11-7-4-8-12-26/h3-21,24H,22H2,1-2H3,(H,35,37)/t24-/m0/s1
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| InChIKey |
ZCTVUUKBVCMSOB-DEOSSOPVSA-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