| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 6th, 2006 | 23 | No |
Popular Name: Bis(methylthio)gliotoxin Bis(methylthio)gliotoxin
Find On: PubMed — Wikipedia — Google
CAS Number: 74149-38-5
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -0.30 | -4.65 | -14.29 | 2 | 6 | 0 | 81 | 356.469 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z81057-1-O | HUVEC (Umbilical Vein Endothelial Cells) (cluster #1 Of 5), Other | Other | 1120 | 0.36 | ADME/T ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z81057 | Z81057 | HUVEC (Umbilical Vein Endothelial Cells) | 1120 | 0.36 | ADME/T ≤ 10μM |
