General Information of the Compound
| Compound ID |
CP0872682
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| Compound Name |
SID92764123
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| Structure |
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| Formula |
C11H12N4O4
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| Molecular Weight |
264.241
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| Canonical SMILES |
O=[N+]([O-])c1cc2no[n+]([O-])c2cc1N1CCCCC1
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| InChI |
InChI=1S/C11H12N4O4/c16-14(17)11-6-8-9(15(18)19-12-8)7-10(11)13-4-2-1-3-5-13/h6-7H,1-5H2
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| InChIKey |
JVZAGLAAFBGAEY-UHFFFAOYSA-N
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| CAS |
61785-82-8
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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: PT06172, Mothers against decapentaplegic homolog 3