General Information of the Compound
| Compound ID |
CP0495769
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| Compound Name |
2-[(1-Piperidinylthiocarbonyl)amino]benzoic Acid
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| Structure |
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| Formula |
C12H15N3O2S
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| Molecular Weight |
265.338
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| Canonical SMILES |
OC(=O)c1ccccc1NC(=S)N1CCNCC1
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| InChI |
InChI=1S/C12H15N3O2S/c16-11(17)9-3-1-2-4-10(9)14-12(18)15-7-5-13-6-8-15/h1-4,13H,5-8H2,(H,14,18)(H,16,17)
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| InChIKey |
ADOZWALRADESMN-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