General Information of the Compound
| Compound ID |
CP0410814
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| Compound Name |
15-fluoro-4-(4-methoxyphenyl)-3,5,10-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),2(6),4,7(12),8,14,16-heptaen-11-one
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| Structure |
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| Formula |
C21H14FN3O2
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| Molecular Weight |
359.36
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| Canonical SMILES |
COc1ccc(cc1)-c1nc2c([nH]1)c1cc[nH]c(=O)c1c1cc(F)ccc21
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| InChI |
InChI=1S/C21H14FN3O2/c1-27-13-5-2-11(3-6-13)20-24-18-14-7-4-12(22)10-16(14)17-15(19(18)25-20)8-9-23-21(17)26/h2-10H,1H3,(H,23,26)(H,24,25)
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| InChIKey |
ADSNNYRCBVHWCE-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