In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 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) | 0.54 | -1.31 | -10.33 | 2 | 5 | 0 | 79 | 234.302 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.00 | -3.58 | -40.85 | 1 | 5 | -1 | 82 | 233.294 | 4 | ↓ |