General Information of the Compound
| Compound ID |
CP0385464
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| Compound Name |
9-(2-fluorophenyl)-12,14-dimethyl-17-(3-methylphenyl)-1,8,12,14-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-2,4,6,10,16-pentaene-13,15-dione
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| Structure |
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| Formula |
C28H23FN4O2
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| Molecular Weight |
466.516
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| Canonical SMILES |
Cc1cccc(c1)-c1n-2c(C(Nc3ccccc-23)c2ccccc2F)c2n(C)c(=O)n(C)c(=O)c12
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| InChI |
InChI=1S/C28H23FN4O2/c1-16-9-8-10-17(15-16)24-22-25(31(2)28(35)32(3)27(22)34)26-23(18-11-4-5-12-19(18)29)30-20-13-6-7-14-21(20)33(24)26/h4-15,23,30H,1-3H3
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| InChIKey |
HUOMRXPRBMUFML-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