In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2004 | 29 | Yes |
Popular Name: 2-[(3,7-dimethyl-2-quinolyl)thio]-N-homoveratryl-acetamide 2-[(3,7-dimethyl-2-quinolyl)thio…
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) | 4.24 | -0.8 | -15.86 | 1 | 5 | 0 | 60 | 410.539 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.24 | -0.66 | -39.79 | 2 | 5 | 1 | 61 | 411.547 | 8 | ↓ |