General Information of the Compound
| Compound ID |
CP0514328
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| Compound Name |
(4S)4-{[(4-Hydroxy-6-phenylpyridin-2-yl)carbonyl]amino}-5-oxo-5-{4-[(pentyloxy)carbonyl]piperazin-1-yl}pentanoic Acid
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| Structure |
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| Formula |
C27H34N4O7
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| Molecular Weight |
526.59
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| Canonical SMILES |
CCCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1cc(O)cc(n1)-c1ccccc1
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| InChI |
InChI=1S/C27H34N4O7/c1-2-3-7-16-38-27(37)31-14-12-30(13-15-31)26(36)21(10-11-24(33)34)29-25(35)23-18-20(32)17-22(28-23)19-8-5-4-6-9-19/h4-6,8-9,17-18,21H,2-3,7,10-16H2,1H3,(H,28,32)(H,29,35)(H,33,34)/t21-/m0/s1
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| InChIKey |
MZHQQCDSQNGZCM-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