General Information of the Compound
| Compound ID |
CP0698515
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| Compound Name |
SID49641429
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| Structure |
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| Formula |
C19H19N3O
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| Molecular Weight |
305.381
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| Canonical SMILES |
Cc1cc(C)c2nc(C)cc(N/N=C/c3ccc(O)cc3)c2c1
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| InChI |
InChI=1S/C19H19N3O/c1-12-8-13(2)19-17(9-12)18(10-14(3)21-19)22-20-11-15-4-6-16(23)7-5-15/h4-11,23H,1-3H3,(H,21,22)/b20-11+
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| InChIKey |
MDMUKNRLKSHWEN-RGVLZGJSSA-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: PT06124, Paired box protein Pax-8