In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 14th, 2010 | 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) | 6.91 | 14.25 | -12.43 | 1 | 7 | 0 | 85 | 525.678 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.99 | 13.21 | -53.64 | 0 | 7 | -1 | 83 | 524.67 | 6 | ↓ |