General Information of the Compound
| Compound ID |
CP0502902
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| Compound Name |
(6aR,9R)-9-(pyrrolidine-1-carbonyl)-N-(1H-pyrrol-3-yl)-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7-carboxamide
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| Structure |
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| Formula |
C24H25N5O2
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| Molecular Weight |
415.497
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| Canonical SMILES |
O=C(Nc1cc[nH]c1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1
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| InChI |
InChI=1S/C24H25N5O2/c30-23(28-8-1-2-9-28)16-10-19-18-4-3-5-20-22(18)15(12-26-20)11-21(19)29(14-16)24(31)27-17-6-7-25-13-17/h3-7,10,12-13,16,21,25-26H,1-2,8-9,11,14H2,(H,27,31)/t16-,21-/m1/s1
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| InChIKey |
DFBGPGQZHLFQOQ-IIBYNOLFSA-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