In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2006 | 40 | 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) | 6.27 | 0.73 | -15.18 | 1 | 6 | 0 | 76 | 533.624 | 11 | ↓ |
Mid Mid (pH 6-8) | 5.68 | 0.58 | -21.25 | 0 | 6 | 0 | 72 | 533.624 | 11 | ↓ |