General Information of the Compound
| Compound ID |
CP0525004
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| Compound Name |
(2S)-2-[[2-(2-fluorophenyl)acetyl]amino]-N-(4-phenoxyphenyl)-3-phenylmethoxypropanamide
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| Structure |
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| Formula |
C30H27FN2O4
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| Molecular Weight |
498.554
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| Canonical SMILES |
Fc1ccccc1CC(=O)N[C@@H](COCc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2)cc1
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| InChI |
InChI=1S/C30H27FN2O4/c31-27-14-8-7-11-23(27)19-29(34)33-28(21-36-20-22-9-3-1-4-10-22)30(35)32-24-15-17-26(18-16-24)37-25-12-5-2-6-13-25/h1-18,28H,19-21H2,(H,32,35)(H,33,34)/t28-/m0/s1
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| InChIKey |
PUUALLLILKGYGE-NDEPHWFRSA-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