General Information of the Compound
| Compound ID |
CP0479242
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| Compound Name |
9-(4-hydroxyphenyl)-4,5,12,14-tetramethyl-17-phenyl-1,8,12,14-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-2(7),3,5,10,16-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 |
Cc1cc2NC(c3n(c(-c4ccccc4)c4c3n(C)c(=O)n(C)c4=O)-c2cc1C)c1ccc(O)cc1
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| InChI |
InChI=1S/C29H26N4O3/c1-16-14-21-22(15-17(16)2)33-25(19-8-6-5-7-9-19)23-26(31(3)29(36)32(4)28(23)35)27(33)24(30-21)18-10-12-20(34)13-11-18/h5-15,24,30,34H,1-4H3
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| InChIKey |
IPYOEPFQYJNKCQ-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