In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2009 | 25 | 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) | -4.27 | -2.35 | -163.58 | 5 | 14 | -2 | 224 | 377.206 | 4 | ↓ |
Mid Mid (pH 6-8) | -3.86 | -4.46 | -216.83 | 4 | 14 | -3 | 227 | 376.198 | 4 | ↓ |
Mid Mid (pH 6-8) | -4.27 | -2.92 | -168.94 | 5 | 14 | -2 | 224 | 377.206 | 4 | ↓ |
Mid Mid (pH 6-8) | -4.27 | -3.51 | -73.1 | 6 | 14 | -1 | 221 | 378.214 | 4 | ↓ |