In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2010 | 20 | 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) | -0.04 | 4.42 | -52.19 | 3 | 5 | 1 | 68 | 274.344 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.04 | 2.23 | -18.18 | 2 | 5 | 0 | 67 | 273.336 | 3 | ↓ |