General Information of the Compound
| Compound ID |
CP0383990
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| Compound Name |
(4S)5-{4-[(Cyclopentyloxy)carbonyl]piperazin-1-yl}-5-oxo-4-{[(6-phenylpyridin-2-yl)carbonyl]amino}pentanoic Acid
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| Structure |
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| Formula |
C27H32N4O6
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| Molecular Weight |
508.575
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| Canonical SMILES |
OC(=O)CC[C@H](NC(=O)c1cccc(n1)-c1ccccc1)C(=O)N1CCN(CC1)C(=O)OC1CCCC1
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| InChI |
InChI=1S/C27H32N4O6/c32-24(33)14-13-23(29-25(34)22-12-6-11-21(28-22)19-7-2-1-3-8-19)26(35)30-15-17-31(18-16-30)27(36)37-20-9-4-5-10-20/h1-3,6-8,11-12,20,23H,4-5,9-10,13-18H2,(H,29,34)(H,32,33)/t23-/m0/s1
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| InChIKey |
KZIQWYAGHMPUFQ-QHCPKHFHSA-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