In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 20 | 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) | 2.62 | 5.57 | -8.25 | 4 | 5 | 0 | 87 | 300.696 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 6.06 | -36.51 | 5 | 5 | 1 | 88 | 301.704 | 4 | ↓ |