General Information of the Compound
| Compound ID |
CP0521896
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| Compound Name |
naphthalen-2-ylmethyl N-[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-[[(1S)-1-phenylethyl]amino]propan-2-yl]carbamate
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| Structure |
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| Formula |
C32H31N3O3
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| Molecular Weight |
505.618
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| Canonical SMILES |
C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccc2ccccc2c1)c1ccccc1
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| InChI |
InChI=1S/C32H31N3O3/c1-22(24-10-4-3-5-11-24)34-30(36)32(2,19-27-20-33-29-15-9-8-14-28(27)29)35-31(37)38-21-23-16-17-25-12-6-7-13-26(25)18-23/h3-18,20,22,33H,19,21H2,1-2H3,(H,34,36)(H,35,37)/t22-,32+/m0/s1
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| InChIKey |
SGQVPBVOTGCWIJ-GHRAFVERSA-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