In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2009 | 19 | 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) | 4.80 | 6.29 | -10.86 | 2 | 3 | 0 | 49 | 283.799 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.80 | 6.95 | -42.91 | 1 | 3 | -1 | 52 | 282.791 | 7 | ↓ |