In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 19 | 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) | 2.47 | 8.93 | -32.35 | 3 | 2 | 1 | 30 | 251.353 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.47 | 6.7 | -4.26 | 2 | 2 | 0 | 29 | 250.345 | 2 | ↓ |