General Information of the Compound
| Compound ID |
CP0038137
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| Compound Name |
(3-(1H-pyrazol-1-yl)phenyl)(5-(2-hydroxyphenyl)-3-(pyridin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl)methanone
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| Structure |
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| Formula |
C24H19N5O2
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| Molecular Weight |
409.449
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| Canonical SMILES |
Oc1ccccc1C1CC(=NN1C(=O)c1cccc(c1)-n1cccn1)c1cccnc1
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| InChI |
InChI=1S/C24H19N5O2/c30-23-10-2-1-9-20(23)22-15-21(18-7-4-11-25-16-18)27-29(22)24(31)17-6-3-8-19(14-17)28-13-5-12-26-28/h1-14,16,22,30H,15H2
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| InChIKey |
TWIBJRRRYBAZFC-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