In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 15 | Yes |
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) | 2.39 | 5.99 | -58.56 | 0 | 3 | -1 | 53 | 200.217 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 6.29 | -30.02 | 1 | 3 | 0 | 54 | 201.225 | 1 | ↓ |