General Information of the Compound
| Compound ID |
CP0535423
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| Compound Name |
(6-((1S,6S)-7-isopropyl-7-azabicyclo[4.1.1]octan-3-yloxy)quinolin-2-yl)(morpholino)methanone
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| Structure |
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| Formula |
C24H31N3O3
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| Molecular Weight |
409.53
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| Canonical SMILES |
CC(C)N1[C@@H]2C[C@H]1CC(CC2)Oc1ccc2nc(ccc2c1)C(=O)N1CCOCC1
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| InChI |
InChI=1S/C24H31N3O3/c1-16(2)27-18-4-5-21(15-19(27)14-18)30-20-6-8-22-17(13-20)3-7-23(25-22)24(28)26-9-11-29-12-10-26/h3,6-8,13,16,18-19,21H,4-5,9-12,14-15H2,1-2H3/t18-,19-,21?/m0/s1
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| InChIKey |
HGYXHBCOZZHBPS-CHEUHSMRSA-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