General Information of the Compound
| Compound ID |
CP0138982
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| Compound Name |
2-[(2S)-5-oxopyrrolidin-2-yl]-1H-1,3-benzodiazole-4-carboxamide
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| Structure |
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| Formula |
C12H12N4O2
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| Molecular Weight |
244.254
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| Canonical SMILES |
NC(=O)c1cccc2nc([nH]c12)[C@@H]1CCC(=O)N1
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| InChI |
InChI=1S/C12H12N4O2/c13-11(18)6-2-1-3-7-10(6)16-12(15-7)8-4-5-9(17)14-8/h1-3,8H,4-5H2,(H2,13,18)(H,14,17)(H,15,16)/t8-/m0/s1
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| InChIKey |
IOHRTULIGFHGAL-QMMMGPOBSA-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