General Information of the Compound
| Compound ID |
CP0445762
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-[6-(Biphenyl-4-sulfonylamino)-1,2,3,4-tetrahydro-carbazol-9-yl]-propionic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H26N2O4S
|
||||||||||||||||||
| Molecular Weight |
474.582
|
||||||||||||||||||
| Canonical SMILES |
OC(=O)CCn1c2CCCCc2c2cc(NS(=O)(=O)c3ccc(cc3)-c3ccccc3)ccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H26N2O4S/c30-27(31)16-17-29-25-9-5-4-8-23(25)24-18-21(12-15-26(24)29)28-34(32,33)22-13-10-20(11-14-22)19-6-2-1-3-7-19/h1-3,6-7,10-15,18,28H,4-5,8-9,16-17H2,(H,30,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
GJOGHJHXXVCJAK-UHFFFAOYSA-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