General Information of the Compound
| Compound ID |
CP0526515
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| Compound Name |
1-(methylnitroso)-6-[2-(morpholin-4-yl)ethoxy]-3-phenyl-N-(propan-2-yl)-1H-indene-2-carboxamide
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| Structure |
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| Formula |
C26H31N3O4
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| Molecular Weight |
449.551
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| Canonical SMILES |
CC(C)NC(=O)c1c(-c2ccccc2)c2ccc(OCCN3CCOCC3)cc2[c-]1[N+](C)=O
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| InChI |
InChI=1S/C26H31N3O4/c1-18(2)27-26(30)24-23(19-7-5-4-6-8-19)21-10-9-20(17-22(21)25(24)28(3)31)33-16-13-29-11-14-32-15-12-29/h4-10,17-18H,11-16H2,1-3H3,(H,27,30)/b28-25+
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| InChIKey |
PABDRXDANVHXTC-AZPGRJICSA-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