In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2006 | 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) | -1.27 | 2.36 | -98.41 | 4 | 4 | 2 | 52 | 185.271 | 2 | ↓ |
Mid Mid (pH 6-8) | -1.27 | 1.96 | -40.55 | 3 | 4 | 1 | 51 | 184.263 | 2 | ↓ |