General Information of the Compound
| Compound ID |
CP0906685
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| Compound Name |
rac-N-(2-fluoro-4-chlorophenyl)-4-[(2,3-dimethyl-1-piperidinyl)carbonyl]-1,3-(5-methyl)thiazol-2-amine
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| Structure |
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| Formula |
C18H21ClFN3OS
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| Molecular Weight |
381.904
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| Canonical SMILES |
Cc1sc(Nc2ccc(Cl)cc2F)nc1C(=O)N1CCCC(C)C1C
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| InChI |
InChI=1S/C18H21ClFN3OS/c1-10-5-4-8-23(11(10)2)17(24)16-12(3)25-18(22-16)21-15-7-6-13(19)9-14(15)20/h6-7,9-11H,4-5,8H2,1-3H3,(H,21,22)
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| InChIKey |
ODUIXUGXPFKQLG-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
Protein ID: PT05347, Short transient receptor potential channel 3
Protein ID: PT04958, Short transient receptor potential channel 6