In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 26 | 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) | 5.94 | 14.91 | -40.71 | 1 | 2 | 1 | 8 | 349.542 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.94 | 12.7 | -3.95 | 0 | 2 | 0 | 6 | 348.534 | 5 | ↓ |