In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 25th, 2010 | 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) | 0.76 | 0.63 | -12.97 | 4 | 5 | 0 | 85 | 220.276 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.76 | 1.09 | -25.41 | 5 | 5 | 1 | 86 | 221.284 | 2 | ↓ |