General Information of the Compound
| Compound ID |
CP0506338
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| Compound Name |
(4S)4-[(1,1'-Biphenyl-3-ylcarbonyl)mino]-5-[4-(3-methylphenyl)piperazin-1-yl]-5-oxopentanoic Acid
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| Structure |
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| Formula |
C29H31N3O4
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| Molecular Weight |
485.584
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| Canonical SMILES |
Cc1cccc(c1)N1CCN(CC1)C(=O)[C@H](CCC(O)=O)NC(=O)c1cccc(c1)-c1ccccc1
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| InChI |
InChI=1S/C29H31N3O4/c1-21-7-5-12-25(19-21)31-15-17-32(18-16-31)29(36)26(13-14-27(33)34)30-28(35)24-11-6-10-23(20-24)22-8-3-2-4-9-22/h2-12,19-20,26H,13-18H2,1H3,(H,30,35)(H,33,34)/t26-/m0/s1
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| InChIKey |
KMNQFXFAIFTNPC-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