General Information of the Compound
| Compound ID |
CP0557767
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| Compound Name |
CHEMBL4562728
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| Formula |
C23H35NO2
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| Molecular Weight |
357.538
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| Canonical SMILES |
CCOC1Cc2ccccc2[C@]2(CC[C@@H](CC2)NCC2CCCCC2)O1
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| InChI |
InChI=1S/C23H35NO2/c1-2-25-22-16-19-10-6-7-11-21(19)23(26-22)14-12-20(13-15-23)24-17-18-8-4-3-5-9-18/h6-7,10-11,18,20,22,24H,2-5,8-9,12-17H2,1H3/t20-,22?,23+
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| InChIKey |
LKSVIRCJQQMHGO-KFWDTITQSA-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