In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 20 | 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) | 3.15 | 6.08 | -47.32 | 3 | 2 | 1 | 31 | 277.407 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.15 | 8.49 | -32.13 | 3 | 2 | 1 | 30 | 277.407 | 3 | ↓ |