In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2010 | 21 | No |
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) | 1.40 | 5.25 | -53.72 | 3 | 7 | 1 | 89 | 297.379 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 3.06 | -17.97 | 2 | 7 | 0 | 87 | 296.371 | 7 | ↓ |