In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 16 | 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) | 2.92 | 8.25 | -109.32 | 3 | 2 | 2 | 21 | 226.408 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.92 | 6.95 | -34.93 | 2 | 2 | 1 | 16 | 225.4 | 3 | ↓ |