General Information of the Compound
| Compound ID |
CP0430071
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| Compound Name |
2-(3,4-dichlorophenyl)-N-[(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
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| Structure |
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| Formula |
C20H17Cl2N3S
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| Molecular Weight |
402.35
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| Canonical SMILES |
Clc1ccc(CCNCc2c(nc3sccn23)-c2ccccc2)cc1Cl
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| InChI |
InChI=1S/C20H17Cl2N3S/c21-16-7-6-14(12-17(16)22)8-9-23-13-18-19(15-4-2-1-3-5-15)24-20-25(18)10-11-26-20/h1-7,10-12,23H,8-9,13H2
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| InChIKey |
ZPWMKEUEFAPJMX-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