General Information of the Compound
| Compound ID |
CP0377669
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| Compound Name |
(6aR,9R)-N-(4-hydroxycyclohexyl)-9-(pyrrolidine-1-carbonyl)-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7-carboxamide
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| Structure |
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| Formula |
C26H32N4O3
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| Molecular Weight |
448.567
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| Canonical SMILES |
OC1CCC(CC1)NC(=O)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1
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| InChI |
InChI=1S/C26H32N4O3/c31-19-8-6-18(7-9-19)28-26(33)30-15-17(25(32)29-10-1-2-11-29)12-21-20-4-3-5-22-24(20)16(14-27-22)13-23(21)30/h3-5,12,14,17-19,23,27,31H,1-2,6-11,13,15H2,(H,28,33)/t17-,18?,19?,23-/m1/s1
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| InChIKey |
FARWCKHTSOBRLC-VSILJMIMSA-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