General Information of the Compound
| Compound ID |
CP0709310
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| Compound Name |
Benzoic acid N'-(5-nitro-furan-2-carbonyl)-hydrazide
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| Structure |
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| Formula |
C12H9N3O5
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| Molecular Weight |
275.22
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| Canonical SMILES |
O=C(NNC(=O)c1ccc([N+](=O)[O-])o1)c1ccccc1
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| InChI |
InChI=1S/C12H9N3O5/c16-11(8-4-2-1-3-5-8)13-14-12(17)9-6-7-10(20-9)15(18)19/h1-7H,(H,13,16)(H,14,17)
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| InChIKey |
NRILHXUEHSTWTI-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: PT06172, Mothers against decapentaplegic homolog 3