General Information of the Compound
| Compound ID |
CP0725066
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| Compound Name |
SID24831169
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| Structure |
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| Formula |
C15H23ClN4OS
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| Molecular Weight |
342.896
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| Canonical SMILES |
COCCn1c(C)cc(C2=NN=C(NC3CC3)SC2)c1C.Cl
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| InChI |
InChI=1S/C15H22N4OS.ClH/c1-10-8-13(11(2)19(10)6-7-20-3)14-9-21-15(18-17-14)16-12-4-5-12;/h8,12H,4-7,9H2,1-3H3,(H,16,18);1H
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| InChIKey |
FRGOEPOOUDNDQW-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
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06124, Paired box protein Pax-8