In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 13 | 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) | -0.17 | 0.11 | -48.52 | 3 | 5 | 1 | 58 | 188.251 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.17 | -1.19 | -8.74 | 2 | 5 | 0 | 54 | 187.243 | 3 | ↓ |