| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 26th, 2009 | 34 | No |
Popular Name: 2-[(5Z)-5-[(3,4-dibenzyloxyphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]acetic 2-[(5Z)-5-[(3,4-dibenzyloxypheny…
| 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) | 3.98 | 14.41 | -58.55 | 0 | 6 | -1 | 81 | 490.582 | 9 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PMT1-1-F | Dolichyl-phosphate-mannose--protein Mannosyltransferase 1 (cluster #1 Of 1), Fungal | Fungi | 2300 | 0.23 | Binding ≤ 10μM |
| Z50442-1-O | Candida Albicans (cluster #1 Of 4), Other | Other | 3000 | 0.23 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PMT1_CANAL | O74189 | Dolichyl-phosphate-mannose--protein Mannosyltransferase 1, Canal | 2300 | 0.23 | Binding ≤ 10μM |
| Z50442 | Z50442 | Candida Albicans | 3000 | 0.23 | Functional ≤ 10μM |
