General Information of the Compound
| Compound ID |
CP0554589
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| Compound Name |
2-(4-flurophenyl)-1,10b-dihydro-benzo[e]pyrazolo[1,5-c][1,3]oxazine-5-spiro-4'-(1'-propylpiperidine)
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| Structure |
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| Formula |
C23H26FN3O
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| Molecular Weight |
379.479
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| Canonical SMILES |
CCCN1CCC2(CC1)Oc1ccccc1C1CC(=NN21)c1ccc(F)cc1
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| InChI |
InChI=1S/C23H26FN3O/c1-2-13-26-14-11-23(12-15-26)27-21(19-5-3-4-6-22(19)28-23)16-20(25-27)17-7-9-18(24)10-8-17/h3-10,21H,2,11-16H2,1H3
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| InChIKey |
KYDXLYCZFCDKCN-UHFFFAOYSA-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