General Information of the Compound
| Compound ID |
CP0475161
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| Compound Name |
5-chloro-2-hydroxy-N-[(2S)-4-methyl-1-oxo-1-[[(2S)-1-oxo-1-[[(2S)-1-oxo-3-phenylpropan-2-yl]amino]-3-phenylpropan-2-yl]amino]pentan-2-yl]benzamide
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| Structure |
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| Formula |
C31H34ClN3O5
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| Molecular Weight |
564.082
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| Canonical SMILES |
CC(C)C[C@H](NC(=O)c1cc(Cl)ccc1O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C=O
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| InChI |
InChI=1S/C31H34ClN3O5/c1-20(2)15-26(34-29(38)25-18-23(32)13-14-28(25)37)31(40)35-27(17-22-11-7-4-8-12-22)30(39)33-24(19-36)16-21-9-5-3-6-10-21/h3-14,18-20,24,26-27,37H,15-17H2,1-2H3,(H,33,39)(H,34,38)(H,35,40)/t24-,26-,27-/m0/s1
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| InChIKey |
QHTDHPCVPRJXDF-URORMMCBSA-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