General Information of the Compound
| Compound ID |
CP0293020
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| Compound Name |
N'-(4-chloro-3-fluorophenyl)-N-(1,2,3,4-tetrahydroisoquinolin-1-ylmethyl)oxamide
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| Structure |
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| Formula |
C18H17ClFN3O2
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| Molecular Weight |
361.804
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| Canonical SMILES |
Fc1cc(NC(=O)C(=O)NCC2NCCc3ccccc23)ccc1Cl
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| InChI |
InChI=1S/C18H17ClFN3O2/c19-14-6-5-12(9-15(14)20)23-18(25)17(24)22-10-16-13-4-2-1-3-11(13)7-8-21-16/h1-6,9,16,21H,7-8,10H2,(H,22,24)(H,23,25)
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| InChIKey |
REQBBGSBIRNOFT-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