In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 13 | 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) | 2.24 | 4.03 | -1.92 | 0 | 2 | 0 | 12 | 183.295 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 6.29 | -1.69 | 1 | 2 | 0 | 14 | 184.303 | 3 | ↓ |