In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 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) | 1.97 | 3.35 | -41.26 | 4 | 3 | 1 | 60 | 227.715 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.97 | 2.23 | -6.88 | 3 | 3 | 0 | 55 | 226.707 | 5 | ↓ |