In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2005 | 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) | 2.50 | 0.2 | -8.94 | 0 | 4 | 0 | 55 | 264.284 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.50 | 0.3 | -40.52 | 1 | 4 | 1 | 57 | 265.292 | 2 | ↓ |