General Information of the Compound
| Compound ID |
CP0501483
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| Compound Name |
3-(4-{4-[4-(tert-Butyl-dimethyl-silanyloxy)-phenyl]-piperazin-1-yl}-butyl)-5-methoxy-1H-indole
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| Structure |
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| Formula |
C29H43N3O2Si
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| Molecular Weight |
493.768
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| Canonical SMILES |
COc1ccc2[nH]cc(CCCCN3CCN(CC3)c3ccc(O[Si](C)(C)C(C)(C)C)cc3)c2c1
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| InChI |
InChI=1S/C29H43N3O2Si/c1-29(2,3)35(5,6)34-25-12-10-24(11-13-25)32-19-17-31(18-20-32)16-8-7-9-23-22-30-28-15-14-26(33-4)21-27(23)28/h10-15,21-22,30H,7-9,16-20H2,1-6H3
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| InChIKey |
DHDVEADFTXAWRR-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