General Information of the Compound
| Compound ID |
CP0559451
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| Compound Name |
N-[(1S)-2-(3-carbamoylanilino)-2-oxo-1-(4-phenylmethoxyphenyl)ethyl]-3-(morpholine-4-carbonyl)benzamide
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| Formula |
C34H32N4O6
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| Molecular Weight |
592.652
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| Canonical SMILES |
NC(=O)c1cccc(NC(=O)[C@@H](NC(=O)c2cccc(c2)C(=O)N2CCOCC2)c2ccc(OCc3ccccc3)cc2)c1
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| InChI |
InChI=1S/C34H32N4O6/c35-31(39)25-8-5-11-28(21-25)36-33(41)30(24-12-14-29(15-13-24)44-22-23-6-2-1-3-7-23)37-32(40)26-9-4-10-27(20-26)34(42)38-16-18-43-19-17-38/h1-15,20-21,30H,16-19,22H2,(H2,35,39)(H,36,41)(H,37,40)/t30-/m0/s1
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| InChIKey |
BSUZGBXDNVNHLS-PMERELPUSA-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