In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 14 | 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) | 1.53 | 4.92 | -46.54 | 3 | 3 | 1 | 44 | 194.302 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.53 | 5.4 | -97.6 | 4 | 3 | 2 | 45 | 195.31 | 5 | ↓ |