In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 12 | 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) | 0.34 | 0.45 | -10.78 | 1 | 4 | 0 | 56 | 167.212 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.34 | 2.42 | -55.69 | 2 | 4 | 1 | 57 | 168.22 | 2 | ↓ |