General Information of the Compound
| Compound ID |
CP0402971
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| Compound Name |
N-[4-cyclopropyl-5-(4-methylpiperazin-1-yl)-1,3-thiazol-2-yl]-3,5-dimethoxybenzamide
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| Structure |
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| Formula |
C20H26N4O3S
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| Molecular Weight |
402.52
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| Canonical SMILES |
COc1cc(OC)cc(c1)C(=O)Nc1nc(C2CC2)c(s1)N1CCN(C)CC1
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| InChI |
InChI=1S/C20H26N4O3S/c1-23-6-8-24(9-7-23)19-17(13-4-5-13)21-20(28-19)22-18(25)14-10-15(26-2)12-16(11-14)27-3/h10-13H,4-9H2,1-3H3,(H,21,22,25)
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| InChIKey |
RWMAJDVCGDVLGH-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