In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2009 | 14 | 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) | 0.51 | 0.13 | -78.25 | 4 | 6 | 0 | 117 | 198.178 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.51 | -0.82 | -55.52 | 5 | 6 | 1 | 114 | 199.186 | 3 | ↓ |