General Information of the Compound
| Compound ID |
CP0504739
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| Compound Name |
2-[(1-Pyrrolidinylcarbonyl)amino]benzoic Acid
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| Structure |
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| Formula |
C12H14N2O3
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| Molecular Weight |
234.255
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| Canonical SMILES |
OC(=O)c1ccccc1NC(=O)N1CCCC1
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| InChI |
InChI=1S/C12H14N2O3/c15-11(16)9-5-1-2-6-10(9)13-12(17)14-7-3-4-8-14/h1-2,5-6H,3-4,7-8H2,(H,13,17)(H,15,16)
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| InChIKey |
QAOIGTCTZRIIDN-UHFFFAOYSA-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