In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 26 | 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) | 3.05 | 7.6 | -34.93 | 6 | 7 | 1 | 118 | 360.482 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.05 | 7.66 | -14.13 | 5 | 7 | 0 | 117 | 359.474 | 4 | ↓ |