General Information of the Compound
| Compound ID |
CP0577923
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| Compound Name |
N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-(2-fluorophenyl)acetamide
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| Structure |
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| Formula |
C18H18FN5O2
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| Molecular Weight |
355.373
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| Canonical SMILES |
CCc1cc(=O)[nH]c(n1)-n1nc(C)cc1NC(=O)Cc1ccccc1F
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| InChI |
InChI=1S/C18H18FN5O2/c1-3-13-10-17(26)22-18(20-13)24-15(8-11(2)23-24)21-16(25)9-12-6-4-5-7-14(12)19/h4-8,10H,3,9H2,1-2H3,(H,21,25)(H,20,22,26)
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| InChIKey |
UIHIXPRVAPKMNT-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
Protein ID: PT06356, Adenylate cyclase type 1
Protein ID: PT06357, Adenylate cyclase type 8