General Information of the Compound
| Compound ID |
CP0445282
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| Compound Name |
((R)-1-{(R)-1-[4-(4-Hydroxy-phenyl)-butylcarbamoyl]-1-methyl-2-phenyl-ethylcarbamoyl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester
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| Structure |
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| Formula |
C34H43N3O5
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| Molecular Weight |
573.734
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| Canonical SMILES |
CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@](C)(Cc1ccccc1)C(=O)NCCCCc1ccc(O)cc1
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| InChI |
InChI=1S/C34H43N3O5/c1-33(2,3)42-32(41)36-29(23-26-14-7-5-8-15-26)30(39)37-34(4,24-27-16-9-6-10-17-27)31(40)35-22-12-11-13-25-18-20-28(38)21-19-25/h5-10,14-21,29,38H,11-13,22-24H2,1-4H3,(H,35,40)(H,36,41)(H,37,39)/t29-,34-/m1/s1
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| InChIKey |
NEAXLFOXMIBFAY-ANHUGMMASA-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