General Information of the Compound
| Compound ID |
CP0389780
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| Compound Name |
CHEMBL4076130
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| Formula |
C23H26N2O3
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| Molecular Weight |
378.472
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| Canonical SMILES |
O[C@]1(CC(=O)Nc2ccc3NC(=O)Cc3c2)CC[C@H](Cc2ccccc2)CC1
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| InChI |
InChI=1S/C23H26N2O3/c26-21-14-18-13-19(6-7-20(18)25-21)24-22(27)15-23(28)10-8-17(9-11-23)12-16-4-2-1-3-5-16/h1-7,13,17,28H,8-12,14-15H2,(H,24,27)(H,25,26)/t17-,23+
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| InChIKey |
DONFPHULRWNWMV-LBEPJEHYSA-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