General Information of the Compound
| Compound ID |
CP0536748
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| Compound Name |
(4S)5-{4-[(Benzyloxy)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 |
C29H30N4O6
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| Molecular Weight |
530.581
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| Canonical SMILES |
OC(=O)CC[C@H](NC(=O)c1cccc(n1)-c1ccccc1)C(=O)N1CCN(CC1)C(=O)OCc1ccccc1
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| InChI |
InChI=1S/C29H30N4O6/c34-26(35)15-14-25(31-27(36)24-13-7-12-23(30-24)22-10-5-2-6-11-22)28(37)32-16-18-33(19-17-32)29(38)39-20-21-8-3-1-4-9-21/h1-13,25H,14-20H2,(H,31,36)(H,34,35)/t25-/m0/s1
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| InChIKey |
IBSLJRBNLBOEAO-VWLOTQADSA-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