In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2006 | 20 | Yes |
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) | 2.02 | 7.15 | -14.37 | 0 | 4 | 0 | 46 | 266.3 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.02 | 7.59 | -30.31 | 1 | 4 | 1 | 48 | 267.308 | 3 | ↓ |