General Information of the Compound
| Compound ID |
CP0110415
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| Compound Name |
(2S)-2-benzamido-5-[2-(1-benzylpiperidin-4-yl)ethylamino]-5-oxopentanoic acid
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| Structure |
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| Formula |
C26H33N3O4
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| Molecular Weight |
451.567
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| Canonical SMILES |
OC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1ccccc1
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| InChI |
InChI=1S/C26H33N3O4/c30-24(12-11-23(26(32)33)28-25(31)22-9-5-2-6-10-22)27-16-13-20-14-17-29(18-15-20)19-21-7-3-1-4-8-21/h1-10,20,23H,11-19H2,(H,27,30)(H,28,31)(H,32,33)/t23-/m0/s1
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| InChIKey |
APDPXKPLRPNYCX-QHCPKHFHSA-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