General Information of the Compound
| Compound ID |
CP0505737
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| Compound Name |
(4S)5-[4-(Butoxycarbonyl)piperazin-1-yl]-5-oxo-4-{[(6-phenylpyridin-2-yl)carbonyl]amino}pentanoic Acid
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| Structure |
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| Formula |
C26H32N4O6
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| Molecular Weight |
496.564
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| Canonical SMILES |
CCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1cccc(n1)-c1ccccc1
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| InChI |
InChI=1S/C26H32N4O6/c1-2-3-18-36-26(35)30-16-14-29(15-17-30)25(34)22(12-13-23(31)32)28-24(33)21-11-7-10-20(27-21)19-8-5-4-6-9-19/h4-11,22H,2-3,12-18H2,1H3,(H,28,33)(H,31,32)/t22-/m0/s1
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| InChIKey |
KHAYMJOODMVXOY-QFIPXVFZSA-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