In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 26th, 2011 | 19 | 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) | 3.63 | 6.32 | -34.34 | 3 | 3 | 1 | 37 | 277.775 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.63 | 6.1 | -4.73 | 2 | 3 | 0 | 35 | 276.767 | 4 | ↓ |