In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 36 | 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) | 3.66 | 8.99 | -20.31 | 1 | 8 | 0 | 74 | 530.716 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.66 | 11.2 | -70.69 | 2 | 8 | 1 | 76 | 531.724 | 7 | ↓ |