General Information of the Compound
| Compound ID |
CP0471984
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| Compound Name |
(6aR,9R)-N9,N9-diethyl-N7-methyl-N7-phenyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-7,9(4H)-dicarboxamide
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| Structure |
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| Formula |
C27H30N4O2
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| Molecular Weight |
442.563
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| Canonical SMILES |
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)N(C)c1ccccc1
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| InChI |
InChI=1S/C27H30N4O2/c1-4-30(5-2)26(32)19-14-22-21-12-9-13-23-25(21)18(16-28-23)15-24(22)31(17-19)27(33)29(3)20-10-7-6-8-11-20/h6-14,16,19,24,28H,4-5,15,17H2,1-3H3/t19-,24-/m1/s1
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| InChIKey |
GBLVWAKPJGOHBU-NTKDMRAZSA-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