In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 20 | 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 | 2.99 | -53.39 | 3 | 7 | 1 | 109 | 320.778 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 2.62 | -51.6 | 2 | 7 | 0 | 111 | 319.77 | 4 | ↓ |