General Information of the Compound
| Compound ID |
CP0922745
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| Compound Name |
6'-amino-1-methyl-5-nitro-2-oxo-2',7'-dihydrospiro[indoline-3,4'-pyrazolo[3,4-b]pyridine]-5'-carbonitrile
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| Formula |
C15H11N7O3
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| Molecular Weight |
337.299
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| Canonical SMILES |
CN1C(=O)C2(C(C#N)=C(N)Nc3n[nH]cc32)c2cc([N+](=O)[O-])ccc21
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| InChI |
InChI=1S/C15H11N7O3/c1-21-11-3-2-7(22(24)25)4-8(11)15(14(21)23)9(5-16)12(17)19-13-10(15)6-18-20-13/h2-4,6H,17H2,1H3,(H2,18,19,20)
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| InChIKey |
KBPCDOAQTLAGTC-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