In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 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) | 1.98 | 5.99 | -97.34 | 4 | 4 | 2 | 54 | 265.401 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 5.56 | -46.57 | 3 | 4 | 1 | 53 | 264.393 | 5 | ↓ |