In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2009 | 33 | 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) | 4.68 | 11.4 | -42.8 | 2 | 7 | 1 | 77 | 485.033 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.68 | 11.83 | -84.97 | 3 | 7 | 2 | 79 | 486.041 | 6 | ↓ |