In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2007 | 24 | Yes |
None
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) | 3.40 | 6.24 | -10.58 | 2 | 5 | 0 | 69 | 339.782 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.40 | 7.01 | -49.88 | 1 | 5 | -1 | 72 | 338.774 | 2 | ↓ |