General Information of the Compound
| Compound ID |
CP0964268
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| Compound Name |
2-(5-methyl-1-(4-oxo-3,4-dihydropyrrolo[1,2-f][1,2,4]triazin-2-yl)-1H-pyrazole-4-carbonyl)octahydrocyclopenta[c]pyrrole-5-carboxamide
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| Structure |
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| Formula |
C19H21N7O3
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| Molecular Weight |
395.423
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| Canonical SMILES |
Cc1c(C(=O)N2CC3CC(C(N)=O)CC3C2)cnn1-c1nn2cccc2c(=O)[nH]1
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| InChI |
InChI=1S/C19H21N7O3/c1-10-14(18(29)24-8-12-5-11(16(20)27)6-13(12)9-24)7-21-26(10)19-22-17(28)15-3-2-4-25(15)23-19/h2-4,7,11-13H,5-6,8-9H2,1H3,(H2,20,27)(H,22,23,28)
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| InChIKey |
QCARHZSFXNCYDX-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