General Information of the Compound
| Compound ID |
CP0451887
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]cyclopropanesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H26FN3O4S
|
||||||||||||||||||
| Molecular Weight |
495.576
|
||||||||||||||||||
| Canonical SMILES |
COc1cccc(c1)[C@@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)[C@H](C)NS(=O)(=O)C1CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H26FN3O4S/c1-17(29-35(31,32)24-11-12-24)26(18-4-3-5-22(14-18)33-2)34-23-10-13-25-19(15-23)16-28-30(25)21-8-6-20(27)7-9-21/h3-10,13-17,24,26,29H,11-12H2,1-2H3/t17-,26-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
DJEKOYRJPGXCQB-QLXKLKPCSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound