In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2009 | 16 | 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) | -2.19 | 0.48 | -50.93 | 5 | 5 | 1 | 89 | 217.252 | 3 | ↓ |
Mid Mid (pH 6-8) | -2.19 | 0.14 | -12.86 | 4 | 5 | 0 | 87 | 216.244 | 3 | ↓ |