General Information of the Compound
| Compound ID |
CP0488286
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| Compound Name |
N-cyclohexyl-5-thia-3,11,12-triazatricyclo[8.3.0.02,6]trideca-1(10),2(6),3,12-tetraen-4-amine
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| Structure |
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| Formula |
C15H20N4S
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| Molecular Weight |
288.42
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| Canonical SMILES |
C1CCC(CC1)Nc1nc-2c(CCCc3[nH]ncc-23)s1
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| InChI |
InChI=1S/C15H20N4S/c1-2-5-10(6-3-1)17-15-18-14-11-9-16-19-12(11)7-4-8-13(14)20-15/h9-10H,1-8H2,(H,16,19)(H,17,18)
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| InChIKey |
VKUVUAOMIMXLNY-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