General Information of the Compound
| Compound ID |
CP0879688
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| Compound Name |
2-Amino-N-(3-chlorobenzyl)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide hydrochloride
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| Structure |
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| Formula |
C16H19Cl2N3OS
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| Molecular Weight |
372.321
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| Canonical SMILES |
CN1CCc2c(sc(N)c2C(=O)NCc2cccc(Cl)c2)C1.Cl
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| InChI |
InChI=1S/C16H18ClN3OS.ClH/c1-20-6-5-12-13(9-20)22-15(18)14(12)16(21)19-8-10-3-2-4-11(17)7-10;/h2-4,7H,5-6,8-9,18H2,1H3,(H,19,21);1H
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| InChIKey |
AOQADHFFXYEIJC-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