General Information of the Compound
| Compound ID |
CP0488928
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| Compound Name |
9-(3-methoxyphenyl)-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 |
C29H26N4O3
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| Molecular Weight |
478.552
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| Canonical SMILES |
COc1cccc(c1)C1Nc2ccccc2-n2c1c1n(C)c(=O)n(C)c(=O)c1c2-c1cccc(C)c1
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| InChI |
InChI=1S/C29H26N4O3/c1-17-9-7-11-19(15-17)25-23-26(31(2)29(35)32(3)28(23)34)27-24(18-10-8-12-20(16-18)36-4)30-21-13-5-6-14-22(21)33(25)27/h5-16,24,30H,1-4H3
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| InChIKey |
MVNNHEJWNDDZSQ-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