In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2009 | 14 | 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) | -0.38 | -1.1 | -21.38 | 3 | 5 | 0 | 85 | 211.246 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.38 | -1.1 | -43.72 | 3 | 5 | 0 | 88 | 211.246 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.38 | -1.5 | -39.13 | 2 | 5 | -1 | 87 | 210.238 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.38 | -0.7 | -66.05 | 4 | 5 | 1 | 86 | 212.254 | 1 | ↓ |