General Information of the Compound
| Compound ID |
CP0947248
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| Compound Name |
2-(4-(azetidine-1-carbonyl)-5-cyclopropyl-1H-pyrazol-1-yl)-7-fluoropyrrolo[1,2-f][1,2,4]triazin-4(3H)-one
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| Structure |
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| Formula |
C16H15FN6O2
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| Molecular Weight |
342.334
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| Canonical SMILES |
O=C(c1cnn(-c2nn3c(F)ccc3c(=O)[nH]2)c1C1CC1)N1CCC1
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| InChI |
InChI=1S/C16H15FN6O2/c17-12-5-4-11-14(24)19-16(20-22(11)12)23-13(9-2-3-9)10(8-18-23)15(25)21-6-1-7-21/h4-5,8-9H,1-3,6-7H2,(H,19,20,24)
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| InChIKey |
QJLMQEVUZVRLFG-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