General Information of the Compound
| Compound ID |
CP0559474
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| Compound Name |
ethyl 5-[(3-chlorophenyl)carbamoyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylate
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| Structure |
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| Formula |
C16H17ClN4O3
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| Molecular Weight |
348.79
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| Canonical SMILES |
CCOC(=O)c1n[nH]c2CCN(Cc12)C(=O)Nc1cccc(Cl)c1
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| InChI |
InChI=1S/C16H17ClN4O3/c1-2-24-15(22)14-12-9-21(7-6-13(12)19-20-14)16(23)18-11-5-3-4-10(17)8-11/h3-5,8H,2,6-7,9H2,1H3,(H,18,23)(H,19,20)
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| InChIKey |
SUUNXJMHBFNPRI-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