General Information of the Compound
| Compound ID |
CP0095875
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| Compound Name |
1-benzyl-3-(5-cyclopropyl-1,2-oxazol-3-yl)pyrazolo[3,4-d]pyrimidin-4-amine
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| Structure |
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| Formula |
C18H16N6O
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| Molecular Weight |
332.367
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| Canonical SMILES |
Nc1ncnc2n(Cc3ccccc3)nc(-c3cc(on3)C3CC3)c12
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| InChI |
InChI=1S/C18H16N6O/c19-17-15-16(13-8-14(25-23-13)12-6-7-12)22-24(18(15)21-10-20-17)9-11-4-2-1-3-5-11/h1-5,8,10,12H,6-7,9H2,(H2,19,20,21)
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| InChIKey |
OWROSELBAIWMET-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: PT00951, Proto-oncogene tyrosine-protein kinase receptor Ret