In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 34 | 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) | 4.89 | 12.87 | -15.57 | 1 | 5 | 0 | 37 | 500.039 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.89 | 15.09 | -64.74 | 2 | 5 | 1 | 38 | 501.047 | 9 | ↓ |