General Information of the Compound
| Compound ID |
CP0911742
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| Compound Name |
4-(4-(2-nitro-1-(2-phenyl-1H-indol-3-yl)ethyl)phenyl)morpholine
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| Formula |
C26H25N3O3
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| Molecular Weight |
427.504
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| Canonical SMILES |
O=[N+]([O-])CC(c1ccc(N2CCOCC2)cc1)c1c(-c2ccccc2)[nH]c2ccccc12
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| InChI |
InChI=1S/C26H25N3O3/c30-29(31)18-23(19-10-12-21(13-11-19)28-14-16-32-17-15-28)25-22-8-4-5-9-24(22)27-26(25)20-6-2-1-3-7-20/h1-13,23,27H,14-18H2
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| InChIKey |
XAXCDRPWYHYBJD-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