In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 24 | 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) | 0.86 | 3.39 | -44.91 | 2 | 7 | 1 | 74 | 358.532 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.86 | 5.52 | -108.89 | 3 | 7 | 2 | 75 | 359.54 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.86 | 3.05 | -44.69 | 2 | 7 | 1 | 74 | 358.532 | 6 | ↓ |