In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 18th, 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) | 3.96 | 9.7 | -15.78 | 1 | 7 | 0 | 89 | 438.563 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.42 | 8.63 | -45.03 | 0 | 7 | -1 | 92 | 437.555 | 6 | ↓ |