In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 14th, 2006 | 25 | 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) | 3.99 | 10.06 | -43.1 | 2 | 4 | 1 | 39 | 337.443 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.99 | 8.87 | -7.67 | 1 | 4 | 0 | 37 | 336.435 | 4 | ↓ |