In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 21 | 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) | -2.05 | 3.69 | -47.75 | 3 | 7 | 0 | 108 | 291.307 | 4 | ↓ |
Mid Mid (pH 6-8) | -2.05 | 1.56 | -51.86 | 2 | 7 | -1 | 107 | 290.299 | 4 | ↓ |