In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2009 | 19 | 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) | 1.57 | 5.57 | -50.16 | 3 | 4 | 1 | 55 | 258.345 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.57 | 5.99 | -100.24 | 4 | 4 | 2 | 56 | 259.353 | 3 | ↓ |