General Information of the Compound
| Compound ID |
CP0473272
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| Compound Name |
N-(6-methylpyridin-2-yl)-5,6-dihydro-4H-pyrazolo[4,3-e][1,3]benzothiazol-2-amine
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| Structure |
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| Formula |
C14H13N5S
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| Molecular Weight |
283.36
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| Canonical SMILES |
Cc1cccc(Nc2nc-3c(CCc4[nH]ncc-34)s2)n1
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| InChI |
InChI=1S/C14H13N5S/c1-8-3-2-4-12(16-8)17-14-18-13-9-7-15-19-10(9)5-6-11(13)20-14/h2-4,7H,5-6H2,1H3,(H,15,19)(H,16,17,18)
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| InChIKey |
XVAGDGYSYFRXHH-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