In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 8th, 2009 | 27 | Yes |
None
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) | 3.05 | 10.46 | -43.37 | 1 | 4 | 1 | 55 | 367.423 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 10.52 | -50.49 | 1 | 4 | 1 | 55 | 367.423 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 8.15 | -8.74 | 0 | 4 | 0 | 54 | 366.415 | 4 | ↓ |