In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2006 | 31 | 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) | 3.21 | 1.75 | -15.02 | 1 | 7 | 0 | 93 | 419.433 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.63 | 1.55 | -22.15 | 0 | 7 | 0 | 89 | 419.433 | 8 | ↓ |