General Information of the Compound
| Compound ID |
CP0413851
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-carbazol-9-yl-3-(5-methyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)propan-2-ol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H21N3O3S
|
||||||||||||||||||
| Molecular Weight |
359.451
|
||||||||||||||||||
| Canonical SMILES |
CN1CCN(CC(O)Cn2c3ccccc3c3ccccc23)S1(=O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H21N3O3S/c1-19-10-11-20(25(19,23)24)12-14(22)13-21-17-8-4-2-6-15(17)16-7-3-5-9-18(16)21/h2-9,14,22H,10-13H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
JOBQDTWJDKUTKJ-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