In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2009 | 37 | 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) | 3.66 | 8.69 | -59.51 | 0 | 8 | -1 | 91 | 505.591 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.66 | 11.02 | -78.53 | 1 | 8 | 0 | 93 | 506.599 | 11 | ↓ |