In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2009 | 37 | 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) | 2.63 | 14.33 | -56.48 | 1 | 9 | -1 | 135 | 504.563 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.63 | 14.44 | -47.93 | 2 | 9 | 0 | 140 | 505.571 | 6 | ↓ |