General Information of the Compound
Compound ID |
CP0530139
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Compound Name |
3-[2-(5-fluoropyridin-2-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carbonyl]benzonitrile
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Structure |
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Formula |
C19H14FN5O
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Molecular Weight |
347.353
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Canonical SMILES |
Fc1ccc(nc1)-c1cc2CN(CCn2n1)C(=O)c1cccc(c1)C#N
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InChI |
InChI=1S/C19H14FN5O/c20-15-4-5-17(22-11-15)18-9-16-12-24(6-7-25(16)23-18)19(26)14-3-1-2-13(8-14)10-21/h1-5,8-9,11H,6-7,12H2
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InChIKey |
RRSPQJKECAMPLZ-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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