In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 8th, 2009 | 28 | 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) | 3.83 | 11 | -45.37 | 3 | 5 | 1 | 63 | 382.528 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.83 | 8.84 | -16.71 | 2 | 5 | 0 | 61 | 381.52 | 7 | ↓ |