General Information of the Compound
| Compound ID |
CP0221713
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| Compound Name |
1,3,3-Trimethyl-9-nitro-4,11-dihydro-3H-indeno[2,1-f]quinoline
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| Structure |
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| Formula |
C19H18N2O2
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| Molecular Weight |
306.365
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| Canonical SMILES |
CC1=CC(C)(C)Nc2ccc-3c(Cc4cc(ccc-34)[N+]([O-])=O)c12
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| InChI |
InChI=1S/C19H18N2O2/c1-11-10-19(2,3)20-17-7-6-15-14-5-4-13(21(22)23)8-12(14)9-16(15)18(11)17/h4-8,10,20H,9H2,1-3H3
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| InChIKey |
HTTJKVFBMIMANI-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