General Information of the Compound
| Compound ID |
CP0333038
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| Compound Name |
6-Fluoro-3-[trans-4-[4-(1H-indol-4-yl)-1-pipera-zinyl]cyclohexyl]-1H-indole
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| Formula |
C26H29FN4
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| Molecular Weight |
416.544
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| Canonical SMILES |
Fc1ccc2c(c[nH]c2c1)[C@H]1CC[C@@H](CC1)N1CCN(CC1)c1cccc2[nH]ccc12
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| InChI |
InChI=1S/C26H29FN4/c27-19-6-9-21-23(17-29-25(21)16-19)18-4-7-20(8-5-18)30-12-14-31(15-13-30)26-3-1-2-24-22(26)10-11-28-24/h1-3,6,9-11,16-18,20,28-29H,4-5,7-8,12-15H2/t18-,20-
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| InChIKey |
AAURBPVIEGZGKT-KESTWPANSA-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