General Information of the Compound
| Compound ID |
CP0389031
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| Compound Name |
N-[(3,4-difluorophenyl)methyl]-8,9-dimethylpyrazolo[3,4-h]quinazolin-4-amine
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| Structure |
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| Formula |
C18H15F2N5
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| Molecular Weight |
339.349
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| Canonical SMILES |
Cc1n(C)nc2ccc3c(NCc4ccc(F)c(F)c4)ncnc3c12
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| InChI |
InChI=1S/C18H15F2N5/c1-10-16-15(24-25(10)2)6-4-12-17(16)22-9-23-18(12)21-8-11-3-5-13(19)14(20)7-11/h3-7,9H,8H2,1-2H3,(H,21,22,23)
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| InChIKey |
RBBATLXBFAPBMH-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