General Information of the Compound
| Compound ID |
CP0536487
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| Compound Name |
(4S)5-Oxo-5-(4-pentanoylpiperazin-1-yl)4-{[(6-phenylpyridin-2-yl)carbonyl]amino}pentanoic acid
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| Structure |
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| Formula |
C30H40N4O5
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| Molecular Weight |
536.673
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| Canonical SMILES |
CCCCC(=O)N1CCN(CC1)C(=O)[C@H](CCC(=O)OC(C)(C)C)NC(=O)c1cccc(n1)-c1ccccc1
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| InChI |
InChI=1S/C30H40N4O5/c1-5-6-15-26(35)33-18-20-34(21-19-33)29(38)25(16-17-27(36)39-30(2,3)4)32-28(37)24-14-10-13-23(31-24)22-11-8-7-9-12-22/h7-14,25H,5-6,15-21H2,1-4H3,(H,32,37)/t25-/m0/s1
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| InChIKey |
PFSBIORJGOPKRO-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