In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 36 | 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) | 6.04 | 14.46 | -73.04 | 1 | 6 | 0 | 74 | 492.66 | 14 | ↓ |
Lo Low (pH 4.5-6) | 6.04 | 13.7 | -46.38 | 2 | 6 | 1 | 71 | 493.668 | 14 | ↓ |