General Information of the Compound
| Compound ID |
CP0535239
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| Compound Name |
N-[4-cyclobutyl-5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-yl]-4-phenylthiophene-2-carboxamide
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| Structure |
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| Formula |
C23H26N4OS2
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| Molecular Weight |
438.622
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| Canonical SMILES |
CN1CCN(CC1)c1sc(NC(=O)c2cc(cs2)-c2ccccc2)nc1C1CCC1
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| InChI |
InChI=1S/C23H26N4OS2/c1-26-10-12-27(13-11-26)22-20(17-8-5-9-17)24-23(30-22)25-21(28)19-14-18(15-29-19)16-6-3-2-4-7-16/h2-4,6-7,14-15,17H,5,8-13H2,1H3,(H,24,25,28)
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| InChIKey |
OZGDPXLICHFJIT-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