In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 13 | No |
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) | 0.56 | 5.4 | -39.73 | 1 | 3 | 1 | 25 | 181.259 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.56 | 3.21 | -7.51 | 0 | 3 | 0 | 24 | 180.251 | 2 | ↓ |