In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2009 | 19 | 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) | 2.73 | 6.65 | -9.74 | 2 | 3 | 0 | 45 | 250.301 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 5.34 | -34.06 | 3 | 3 | 1 | 50 | 251.309 | 3 | ↓ |