General Information of the Compound
| Compound ID |
CP0399712
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| Compound Name |
8-fluoro-4-[2-(6-methylpyridin-2-yl)-4H,5H,6H-pyrrolo[1,2-a]pyrazol-3-yl]quinoline
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| Structure |
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| Formula |
C21H17FN4
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| Molecular Weight |
344.393
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| Canonical SMILES |
Cc1cccc(n1)-c1nn2CCCc2c1-c1ccnc2c(F)cccc12
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| InChI |
InChI=1S/C21H17FN4/c1-13-5-2-8-17(24-13)21-19(18-9-4-12-26(18)25-21)14-10-11-23-20-15(14)6-3-7-16(20)22/h2-3,5-8,10-11H,4,9,12H2,1H3
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| InChIKey |
ZPHQLVMXWRIBTR-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