In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 29 | No |
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) | -4.94 | -6.44 | -370.78 | 4 | 17 | -4 | 282 | 479.124 | 8 | ↓ |
Mid Mid (pH 6-8) | -4.94 | -7.59 | -233.56 | 5 | 17 | -3 | 279 | 480.132 | 8 | ↓ |