In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 20 | 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) | 1.89 | 2.58 | -10.14 | 0 | 5 | 0 | 56 | 299.392 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.89 | 4.72 | -43.84 | 1 | 5 | 1 | 57 | 300.4 | 5 | ↓ |