In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2011 | 28 | 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) | 2.81 | 8.07 | -10.38 | 1 | 7 | 0 | 90 | 492.269 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.27 | 5.64 | -41.69 | 0 | 7 | -1 | 93 | 491.261 | 5 | ↓ |