In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 15 | 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) | 1.77 | 4.82 | -100.39 | 4 | 3 | 2 | 41 | 218.385 | 10 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 5.35 | -39.81 | 3 | 3 | 1 | 44 | 217.377 | 10 | ↓ |