General Information of the Compound
| Compound ID |
CP0473971
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| Compound Name |
(6aR,9R)-N9,N9-diethyl-N7-(pyridin-2-yl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-7,9(4H)-dicarboxamide
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| Structure |
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| Formula |
C25H27N5O2
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| Molecular Weight |
429.524
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| Canonical SMILES |
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccn1
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| InChI |
InChI=1S/C25H27N5O2/c1-3-29(4-2)24(31)17-12-19-18-8-7-9-20-23(18)16(14-27-20)13-21(19)30(15-17)25(32)28-22-10-5-6-11-26-22/h5-12,14,17,21,27H,3-4,13,15H2,1-2H3,(H,26,28,32)/t17-,21-/m1/s1
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| InChIKey |
URGPCWMZYZACKR-DYESRHJHSA-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