In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2009 | 34 | 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) | -0.63 | 4 | -75.58 | 4 | 12 | -1 | 181 | 503.542 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.63 | 4.98 | -124.14 | 3 | 12 | -2 | 184 | 502.534 | 7 | ↓ |