In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2007 | 34 | 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) | 3.55 | 12.38 | -74.96 | 1 | 9 | 0 | 120 | 467.522 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.97 | 1.68 | -53.69 | 1 | 9 | 1 | 113 | 468.53 | 11 | ↓ |