General Information of the Compound
| Compound ID |
CP0472141
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(7R,8R)-7-hydroxy-8-[(4-pentylphenyl)sulfonylamino]-5,6,7,8-tetrahydronaphthalen-2-yl]-3-methoxybenzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H34N2O5S
|
||||||||||||||||||
| Molecular Weight |
522.667
|
||||||||||||||||||
| Canonical SMILES |
CCCCCc1ccc(cc1)S(=O)(=O)N[C@H]1[C@H](O)CCc2ccc(NC(=O)c3cccc(OC)c3)cc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H34N2O5S/c1-3-4-5-7-20-10-15-25(16-11-20)37(34,35)31-28-26-19-23(14-12-21(26)13-17-27(28)32)30-29(33)22-8-6-9-24(18-22)36-2/h6,8-12,14-16,18-19,27-28,31-32H,3-5,7,13,17H2,1-2H3,(H,30,33)/t27-,28-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
PGLNHGAPUYXBAT-VSGBNLITSA-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