General Information of the Compound
| Compound ID |
CP0510032
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| Compound Name |
1,2,3,4-tetrahydronaphthalen-2-yl 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 |
C31H33N3O3
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| Molecular Weight |
495.623
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| Canonical SMILES |
C[C@H](NC(=O)[C@@](C)(Cc1c[nH]c2ccccc12)NC(=O)OC1CCc2ccccc2C1)c1ccccc1
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| InChI |
InChI=1S/C31H33N3O3/c1-21(22-10-4-3-5-11-22)33-29(35)31(2,19-25-20-32-28-15-9-8-14-27(25)28)34-30(36)37-26-17-16-23-12-6-7-13-24(23)18-26/h3-15,20-21,26,32H,16-19H2,1-2H3,(H,33,35)(H,34,36)/t21-,26?,31+/m0/s1
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| InChIKey |
MUTNKBJTTJGMMF-QBQHLJAFSA-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