General Information of the Compound
| Compound ID |
CP0495702
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| Compound Name |
CHEMBL518254
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| Formula |
C25H26ClNO2
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| Molecular Weight |
407.941
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| Canonical SMILES |
O[C@H]1CC[C@@H](CC1)N(CCc1ccc(Cl)cc1)C(=O)c1cccc2ccccc12
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| InChI |
InChI=1S/C25H26ClNO2/c26-20-10-8-18(9-11-20)16-17-27(21-12-14-22(28)15-13-21)25(29)24-7-3-5-19-4-1-2-6-23(19)24/h1-11,21-22,28H,12-17H2/t21-,22-
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| InChIKey |
SFLKPYFQQSLPMF-HZCBDIJESA-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