In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 17 | 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) | 0.41 | 3.23 | -57.45 | 2 | 6 | -1 | 94 | 236.251 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.41 | 2.11 | -17.89 | 3 | 6 | 0 | 91 | 237.259 | 6 | ↓ |