In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 16 | 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) | 2.36 | 5.53 | -53.61 | 1 | 5 | -1 | 78 | 242.638 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.36 | 3.54 | -10.91 | 2 | 5 | 0 | 76 | 243.646 | 5 | ↓ |