General Information of the Compound
| Compound ID |
CP0382099
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| Compound Name |
4-methoxy-1-(oxan-4-ylmethyl)-3-[(2,2,3,3-tetramethylcyclopropyl)carbonyl]-1H-indole
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| Structure |
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| Formula |
C23H31NO3
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| Molecular Weight |
369.505
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| Canonical SMILES |
COc1cccc2n(CC3CCOCC3)cc(C(=O)C3C(C)(C)C3(C)C)c12
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| InChI |
InChI=1S/C23H31NO3/c1-22(2)21(23(22,3)4)20(25)16-14-24(13-15-9-11-27-12-10-15)17-7-6-8-18(26-5)19(16)17/h6-8,14-15,21H,9-13H2,1-5H3
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| InChIKey |
OJELZJGBPRGETA-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