In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 29 | 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) | 4.20 | 10.39 | -23.94 | 1 | 6 | 0 | 75 | 491.798 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.38 | 8.38 | -57.29 | 0 | 6 | -1 | 82 | 490.79 | 4 | ↓ |