In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2006 | 26 | 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) | 3.73 | 2.64 | -61.41 | 2 | 5 | 1 | 99 | 385.278 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.73 | 2.46 | -111.53 | 3 | 5 | 2 | 101 | 386.286 | 1 | ↓ |