General Information of the Compound
| Compound ID |
CP0574261
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| Compound Name |
(3R)-1-benzyl-N-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-5-oxopyrrolidine-3-carboxamide
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| Structure |
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| Formula |
C27H24N4O3
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| Molecular Weight |
452.514
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| Canonical SMILES |
Cc1ccc(cc1)-c1noc(n1)-c1ccc(NC(=O)[C@H]2CN(Cc3ccccc3)C(=O)C2)cc1
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| InChI |
InChI=1S/C27H24N4O3/c1-18-7-9-20(10-8-18)25-29-27(34-30-25)21-11-13-23(14-12-21)28-26(33)22-15-24(32)31(17-22)16-19-5-3-2-4-6-19/h2-14,22H,15-17H2,1H3,(H,28,33)/t22-/m1/s1
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| InChIKey |
NQHZXTJSTCDDNV-JOCHJYFZSA-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