In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 14 | 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) | 2.93 | 5.07 | -5.49 | 2 | 3 | 0 | 52 | 193.294 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.93 | 5.47 | -23.89 | 3 | 3 | 1 | 53 | 194.302 | 2 | ↓ |