In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 12 | 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) | -0.75 | -2.64 | -46.18 | 5 | 4 | 1 | 77 | 173.236 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.75 | -3.03 | -8.55 | 4 | 4 | 0 | 75 | 172.228 | 2 | ↓ |