In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 18th, 2008 | 29 | 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) | 4.00 | 12.89 | -42.95 | 1 | 6 | 1 | 61 | 431.969 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.00 | 10.39 | -10.97 | 0 | 6 | 0 | 60 | 430.961 | 8 | ↓ |