General Information of the Compound
| Compound ID |
CP0410720
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| Compound Name |
1-cyclopropyl-3-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)urea
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| Structure |
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| Formula |
C13H15N3O2S
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| Molecular Weight |
277.349
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| Canonical SMILES |
COc1ccc(C)c2sc(NC(=O)NC3CC3)nc12
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| InChI |
InChI=1S/C13H15N3O2S/c1-7-3-6-9(18-2)10-11(7)19-13(15-10)16-12(17)14-8-4-5-8/h3,6,8H,4-5H2,1-2H3,(H2,14,15,16,17)
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| InChIKey |
FVXDAUGNDAHAJO-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