In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2004 | 24 | 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) | 1.45 | 7.77 | -61.04 | 1 | 6 | -1 | 87 | 340.384 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.52 | 6.57 | -147.42 | 0 | 6 | -2 | 93 | 339.376 | 2 | ↓ |