In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 33 | 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) | 7.21 | 14.47 | -6.01 | 1 | 2 | 0 | 19 | 432.542 | 4 | ↓ |
Mid Mid (pH 6-8) | 7.21 | 16.56 | -27.37 | 2 | 2 | 1 | 20 | 433.55 | 4 | ↓ |