In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 2006 | 38 | 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) | 4.68 | 1.84 | -49.85 | 2 | 8 | 1 | 89 | 525.666 | 14 | ↓ |
Mid Mid (pH 6-8) | 4.09 | 1.75 | -59.73 | 1 | 8 | 1 | 86 | 525.666 | 14 | ↓ |