In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 22 | 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) | 1.04 | 1.32 | -54 | 1 | 7 | -1 | 99 | 327.382 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.04 | 3.6 | -80.25 | 2 | 7 | 0 | 100 | 328.39 | 7 | ↓ |