General Information of the Compound
| Compound ID |
CP0270953
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| Compound Name |
4-(3-fluoro-4-methoxyphenyl)-5,16-diazatetracyclo[8.6.0.02,7.011,15]hexadeca-1(10),2,4,6,8,11(15)-hexaen-12-one
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| Structure |
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| Formula |
C21H15FN2O2
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| Molecular Weight |
346.361
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| Canonical SMILES |
COc1ccc(cc1F)-c1cc2c3[nH]c4CCC(=O)c4c3ccc2cn1
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| InChI |
InChI=1S/C21H15FN2O2/c1-26-19-7-3-11(8-15(19)22)17-9-14-12(10-23-17)2-4-13-20-16(24-21(13)14)5-6-18(20)25/h2-4,7-10,24H,5-6H2,1H3
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| InChIKey |
MBAFFKJSYQWZHU-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