General Information of the Compound
| Compound ID |
CP0489116
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| Compound Name |
(4S)5-{4-[(Cyclopentylmethoxy)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 |
C28H34N4O6
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| Molecular Weight |
522.602
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| Canonical SMILES |
OC(=O)CC[C@H](NC(=O)c1cccc(n1)-c1ccccc1)C(=O)N1CCN(CC1)C(=O)OCC1CCCC1
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| InChI |
InChI=1S/C28H34N4O6/c33-25(34)14-13-24(30-26(35)23-12-6-11-22(29-23)21-9-2-1-3-10-21)27(36)31-15-17-32(18-16-31)28(37)38-19-20-7-4-5-8-20/h1-3,6,9-12,20,24H,4-5,7-8,13-19H2,(H,30,35)(H,33,34)/t24-/m0/s1
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| InChIKey |
WSFPOQJWAMIGPU-DEOSSOPVSA-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