In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 35 | 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) | 5.32 | 13.4 | -47.95 | 3 | 7 | 1 | 81 | 502.973 | 9 | ↓ |
Mid Mid (pH 6-8) | 5.32 | 11.15 | -11.53 | 2 | 7 | 0 | 79 | 501.965 | 9 | ↓ |