General Information of the Compound
| Compound ID |
CP0389583
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| Compound Name |
(S)-5-oxo-4-(4-phenylpicolinamido)-5-(4-(propionyloxy)piperazin-1-yl)pentanoic acid
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| Structure |
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| Formula |
C24H28N4O6
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| Molecular Weight |
468.51
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| Canonical SMILES |
CCC(=O)ON1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1cc(ccn1)-c1ccccc1
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| InChI |
InChI=1S/C24H28N4O6/c1-2-22(31)34-28-14-12-27(13-15-28)24(33)19(8-9-21(29)30)26-23(32)20-16-18(10-11-25-20)17-6-4-3-5-7-17/h3-7,10-11,16,19H,2,8-9,12-15H2,1H3,(H,26,32)(H,29,30)/t19-/m0/s1
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| InChIKey |
ZZEYSHVFQJAYFG-IBGZPJMESA-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