General Information of the Compound
| Compound ID |
CP0955878
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| Compound Name |
6'-amino-5-fluoro-1,3'-dimethyl-2-oxo-2',7'-dihydrospiro[indoline-3,4'-pyrazolo[3,4-b]pyridine]-5'-carbonitrile
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| Formula |
C16H13FN6O
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| Molecular Weight |
324.319
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| Canonical SMILES |
Cc1[nH]nc2c1C1(C(=O)N(C)c3ccc(F)cc31)C(C#N)=C(N)N2
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| InChI |
InChI=1S/C16H13FN6O/c1-7-12-14(22-21-7)20-13(19)10(6-18)16(12)9-5-8(17)3-4-11(9)23(2)15(16)24/h3-5H,19H2,1-2H3,(H2,20,21,22)
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| InChIKey |
PCLLMFIKNQZIHK-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: PT03381, 5'-nucleotidase
Protein ID: PT04712, 5'-nucleotidase