In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 17 | 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) | 3.15 | 6.55 | -45.66 | 1 | 4 | -1 | 65 | 250.661 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.15 | 4.57 | -7.09 | 2 | 4 | 0 | 62 | 251.669 | 4 | ↓ |