General Information of the Compound
| Compound ID |
CP0955942
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| Compound Name |
14-fluoro-7-methyl-3,9,10,19-tetrazapentacyclo[14.2.1.03,7.08,18.012,17]nonadeca-1(18),8,12(17),13,15-pentaen-11-one
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| Formula |
C16H15FN4O
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| Molecular Weight |
298.321
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| Canonical SMILES |
CC12CCCN1Cc1[nH]c3cc(F)cc4c3c1C2=NNC4=O
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| InChI |
InChI=1S/C16H15FN4O/c1-16-3-2-4-21(16)7-11-13-12-9(15(22)20-19-14(13)16)5-8(17)6-10(12)18-11/h5-6,18H,2-4,7H2,1H3,(H,20,22)
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| InChIKey |
NQRAYRDWMXKNOG-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