In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 31 | No |
Popular Name: (5Z)-3-hexyl-5-[(8-methyl-2-morpholino-3-quinolyl)methylene]-2-thioxo-thiazolidin-4-one (5Z)-3-hexyl-5-[(8-methyl-2-morp…
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) | 4.97 | 13.61 | -8.25 | 0 | 5 | 0 | 47 | 455.649 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.97 | 13.97 | -33.54 | 1 | 5 | 1 | 49 | 456.657 | 7 | ↓ |