In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2012 | 27 | 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) | 3.24 | 10.58 | -43.92 | 2 | 5 | 1 | 54 | 386.903 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 8.39 | -17.1 | 1 | 5 | 0 | 53 | 385.895 | 5 | ↓ |