General Information of the Compound
| Compound ID |
CP0372481
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| Compound Name |
N-[(2R)-1-[acetyl-[(2-methoxyphenyl)methyl]amino]-3-(1H-indol-3-yl)propan-2-yl]-4-oxo-4-phenylbutanamide
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| Structure |
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| Formula |
C31H33N3O4
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| Molecular Weight |
511.622
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| Canonical SMILES |
COc1ccccc1CN(C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CCC(=O)c1ccccc1)C(C)=O
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| InChI |
InChI=1S/C31H33N3O4/c1-22(35)34(20-24-12-6-9-15-30(24)38-2)21-26(18-25-19-32-28-14-8-7-13-27(25)28)33-31(37)17-16-29(36)23-10-4-3-5-11-23/h3-15,19,26,32H,16-18,20-21H2,1-2H3,(H,33,37)/t26-/m1/s1
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| InChIKey |
ZDEIAFJLFFATFK-AREMUKBSSA-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