General Information of the Compound
| Compound ID |
CP0926446
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| Compound Name |
3-(1-nitro-3-phenylpropan-2-yl)-2-phenyl-1H-indole
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| Formula |
C23H20N2O2
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| Molecular Weight |
356.425
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| Canonical SMILES |
O=[N+]([O-])CC(Cc1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12
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| InChI |
InChI=1S/C23H20N2O2/c26-25(27)16-19(15-17-9-3-1-4-10-17)22-20-13-7-8-14-21(20)24-23(22)18-11-5-2-6-12-18/h1-14,19,24H,15-16H2
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| InChIKey |
GKQGDPUISOETSU-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