General Information of the Compound
| Compound ID |
CP0564733
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| Compound Name |
11-fluoro-3-(2,2,3,3-tetramethylcyclopropanecarbonyl)-3,6,7,16-tetrazatetracyclo[11.2.1.05,15.09,14]hexadeca-1(15),5,9(14),10,12-pentaen-8-one
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| Formula |
C20H21FN4O2
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| Molecular Weight |
368.412
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| Canonical SMILES |
CC1(C)C(C(=O)N2Cc3[nH]c4cc(F)cc5c4c3c(C2)n[nH]c5=O)C1(C)C
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| InChI |
InChI=1S/C20H21FN4O2/c1-19(2)16(20(19,3)4)18(27)25-7-12-15-13(8-25)23-24-17(26)10-5-9(21)6-11(22-12)14(10)15/h5-6,16,22H,7-8H2,1-4H3,(H,24,26)
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| InChIKey |
AKWDMQGDJNHZOY-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