In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2011 | 33 | 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) | -4.75 | -2.17 | -497.41 | 2 | 19 | -5 | 305 | 557.107 | 10 | ↓ |
Mid Mid (pH 6-8) | -4.75 | -3.33 | -348.8 | 3 | 19 | -4 | 302 | 558.115 | 10 | ↓ |