In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2009 | 36 | No |
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) | -3.91 | 14.91 | -81.42 | 2 | 6 | 2 | 59 | 490.644 | 4 | ↓ |
Hi High (pH 8-9.5) | -3.91 | 15.21 | -62.75 | 1 | 6 | 1 | 62 | 489.636 | 4 | ↓ |