General Information of the Compound
| Compound ID |
CP0405680
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| Compound Name |
2'-Methoxybiphenyl-4-carboxylic acid{4-[4-(2,4-dimethoxyphenyl)piperazin-1-yl]butyl}amide
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| Structure |
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| Formula |
C30H37N3O4
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| Molecular Weight |
503.643
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| Canonical SMILES |
COc1ccc(N2CCN(CCCCNC(=O)c3ccc(cc3)-c3ccccc3OC)CC2)c(OC)c1
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| InChI |
InChI=1S/C30H37N3O4/c1-35-25-14-15-27(29(22-25)37-3)33-20-18-32(19-21-33)17-7-6-16-31-30(34)24-12-10-23(11-13-24)26-8-4-5-9-28(26)36-2/h4-5,8-15,22H,6-7,16-21H2,1-3H3,(H,31,34)
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| InChIKey |
BJYPPVFXTPZIDK-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