General Information of the Compound
| Compound ID |
CP0905509
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| Compound Name |
2-Amino-N-benzyl-6-methyl-4,5,6,7-tetrahydrothieno-[2,3-c]pyridine-3-carboxamide hydrochloride
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| Structure |
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| Formula |
C16H20ClN3OS
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| Molecular Weight |
337.876
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| Canonical SMILES |
CN1CCc2c(sc(N)c2C(=O)NCc2ccccc2)C1.Cl
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| InChI |
InChI=1S/C16H19N3OS.ClH/c1-19-8-7-12-13(10-19)21-15(17)14(12)16(20)18-9-11-5-3-2-4-6-11;/h2-6H,7-10,17H2,1H3,(H,18,20);1H
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| InChIKey |
ATKFWKYHWVDWLO-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