General Information of the Compound
| Compound ID |
CP0918864
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| Compound Name |
(4-(4-fluorophenyl)piperazin-1-yl)(5-methyl-7-m-tolyl-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl)methanone
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| Structure |
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| Formula |
C25H26FN5O
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| Molecular Weight |
431.515
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| Canonical SMILES |
CC1=C(C(=O)N2CCN(c3ccc(F)cc3)CC2)C(c2cccc(C)c2)n2nccc2N1
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| InChI |
InChI=1S/C25H26FN5O/c1-17-4-3-5-19(16-17)24-23(18(2)28-22-10-11-27-31(22)24)25(32)30-14-12-29(13-15-30)21-8-6-20(26)7-9-21/h3-11,16,24,28H,12-15H2,1-2H3
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| InChIKey |
BQALJAYVWFPJHY-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