In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2006 | 35 | No |
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) | 2.00 | -2.53 | -62.35 | 3 | 9 | 1 | 109 | 483.541 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.42 | -2.7 | -71.56 | 2 | 9 | 1 | 106 | 483.541 | 9 | ↓ |