General Information of the Compound
| Compound ID |
CP0633379
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| Compound Name |
SID22403046
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| Structure |
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| Formula |
C12H12ClN5O2
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| Molecular Weight |
293.714
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| Canonical SMILES |
COc1cccc(/C=N/Nc2ncnc(Cl)c2N)c1O
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| InChI |
InChI=1S/C12H12ClN5O2/c1-20-8-4-2-3-7(10(8)19)5-17-18-12-9(14)11(13)15-6-16-12/h2-6,19H,14H2,1H3,(H,15,16,18)/b17-5+
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| InChIKey |
LWVGPJZEDBOXHD-YAXRCOADSA-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: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06101, Latent membrane protein 1
Protein ID: PT06172, Mothers against decapentaplegic homolog 3