In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 25 | Yes |
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) | 5.94 | 14.79 | -43.42 | 1 | 3 | 1 | 22 | 342.551 | 9 | ↓ |
Mid Mid (pH 6-8) | 5.94 | 15.09 | -93.89 | 2 | 3 | 2 | 24 | 343.559 | 9 | ↓ |