General Information of the Compound
| Compound ID |
CP0265865
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| Compound Name |
(S)-3-biphenyl-4-yl-2-(7-hydroxycarbamoyl-heptanoylamino)-propionic acid methyl ester
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| Structure |
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| Formula |
C24H30N2O5
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| Molecular Weight |
426.513
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| Canonical SMILES |
COC(=O)[C@H](Cc1ccc(cc1)-c1ccccc1)NC(=O)CCCCCCC(=O)NO
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| InChI |
InChI=1S/C24H30N2O5/c1-31-24(29)21(25-22(27)11-7-2-3-8-12-23(28)26-30)17-18-13-15-20(16-14-18)19-9-5-4-6-10-19/h4-6,9-10,13-16,21,30H,2-3,7-8,11-12,17H2,1H3,(H,25,27)(H,26,28)/t21-/m0/s1
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| InChIKey |
NNEAUAUOLKPOJY-NRFANRHFSA-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