In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 34 | 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) | 3.95 | 10.35 | -13.68 | 0 | 7 | 0 | 59 | 478.549 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.95 | 12.55 | -60.03 | 1 | 7 | 1 | 61 | 479.557 | 4 | ↓ |