In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2009 | 33 | 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) | 5.00 | 13.99 | -11.77 | 0 | 6 | 0 | 54 | 463.651 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.00 | 15.97 | -47.96 | 1 | 6 | 1 | 55 | 464.659 | 8 | ↓ |