In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 12th, 2009 | 27 | No |
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) | 3.46 | 6.85 | -48.16 | 0 | 6 | -1 | 78 | 382.827 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 8.61 | -11.29 | 1 | 6 | 0 | 75 | 383.835 | 3 | ↓ |