General Information of the Compound
| Compound ID |
CP0510710
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| Compound Name |
(4S)4-({[4-(Acetylamino)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 |
C33H45N5O7
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| Molecular Weight |
623.751
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| Canonical SMILES |
CCCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(=O)OC(C)(C)C)NC(=O)c1cc(NC(C)=O)cc(n1)-c1ccccc1
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| InChI |
InChI=1S/C33H45N5O7/c1-6-7-11-20-44-32(43)38-18-16-37(17-19-38)31(42)26(14-15-29(40)45-33(3,4)5)36-30(41)28-22-25(34-23(2)39)21-27(35-28)24-12-9-8-10-13-24/h8-10,12-13,21-22,26H,6-7,11,14-20H2,1-5H3,(H,36,41)(H,34,35,39)/t26-/m0/s1
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| InChIKey |
OTEJZZDDDMFQDY-SANMLTNESA-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