In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 21 | 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) | 3.29 | 5.63 | -11.67 | 2 | 4 | 0 | 57 | 280.327 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 6.12 | -30.89 | 3 | 4 | 1 | 59 | 281.335 | 4 | ↓ |