In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 18 | 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) | 2.56 | 4.79 | -30.94 | 3 | 4 | 0 | 80 | 256.183 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 4.41 | -54.12 | 2 | 4 | -1 | 79 | 255.175 | 2 | ↓ |