General Information of the Compound
| Compound ID |
CP0509961
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| Compound Name |
6-fluoro-2-methylsulfanyl-5-piperazin-1-yl-1H-benzimidazole
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| Structure |
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| Formula |
C12H15FN4S
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| Molecular Weight |
266.345
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| Canonical SMILES |
CSc1nc2cc(F)c(cc2[nH]1)N1CCNCC1
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| InChI |
InChI=1S/C12H15FN4S/c1-18-12-15-9-6-8(13)11(7-10(9)16-12)17-4-2-14-3-5-17/h6-7,14H,2-5H2,1H3,(H,15,16)
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| InChIKey |
RPKPHHAOHRYPRW-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