In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 25 | 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) | -1.53 | -2.04 | -69.11 | 8 | 10 | 1 | 156 | 371.443 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.81 | -2.45 | -85.65 | 7 | 10 | 0 | 153 | 370.435 | 7 | ↓ |