General Information of the Compound
| Compound ID |
CP0839261
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| Compound Name |
2-(5-methyl-4-(piperidine-1-carbonyl)-1H-pyrazol-1-yl)pyrrolo[1,2-f][1,2,4]triazin-4(3H)-one
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| Structure |
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| Formula |
C16H18N6O2
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| Molecular Weight |
326.36
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| Canonical SMILES |
Cc1c(C(=O)N2CCCCC2)cnn1-c1nn2cccc2c(=O)[nH]1
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| InChI |
InChI=1S/C16H18N6O2/c1-11-12(15(24)20-7-3-2-4-8-20)10-17-22(11)16-18-14(23)13-6-5-9-21(13)19-16/h5-6,9-10H,2-4,7-8H2,1H3,(H,18,19,23)
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| InChIKey |
VIPRGSLECBMCOO-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