General Information of the Compound
| Compound ID |
CP0885131
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| Compound Name |
SID17432820
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| Structure |
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| Formula |
C19H20N2O3
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| Molecular Weight |
324.38
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| Canonical SMILES |
Cc1ccc(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1
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| InChI |
InChI=1S/C19H20N2O3/c1-14-5-7-15(8-6-14)19(22)17-13-16(21(23)24)9-10-18(17)20-11-3-2-4-12-20/h5-10,13H,2-4,11-12H2,1H3
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| InChIKey |
KYUNCRLYSFICHA-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: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06124, Paired box protein Pax-8