General Information of the Compound
| Compound ID |
CP0941276
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| Compound Name |
(1R,2R)-2-{[4-({[(4-methoxyphenyl)amino]carbonyl}amino)-1,1-biphenyl-4-yl]carbonyl}cyclopentanecarboxylic acid
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| Structure |
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| Formula |
C27H25FN2O5
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| Molecular Weight |
476.504
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| Canonical SMILES |
COc1ccc(NC(=O)Nc2ccc(-c3ccc(C(=O)[C@@H]4CCC[C@H]4C(=O)O)cc3)cc2F)cc1
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| InChI |
InChI=1S/C27H25FN2O5/c1-35-20-12-10-19(11-13-20)29-27(34)30-24-14-9-18(15-23(24)28)16-5-7-17(8-6-16)25(31)21-3-2-4-22(21)26(32)33/h5-15,21-22H,2-4H2,1H3,(H,32,33)(H2,29,30,34)/t21-,22-/m1/s1
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| InChIKey |
DNQIMMFBUCNLFX-FGZHOGPDSA-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
Protein ID: PT02536, Diacylglycerol O-acyltransferase 1
Protein ID: PT02560, Diacylglycerol O-acyltransferase 1