In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2006 | 27 | 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) | 3.73 | 10.77 | -14.05 | 1 | 7 | 0 | 82 | 367.453 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.91 | 11.06 | -33.46 | 2 | 7 | 1 | 87 | 368.461 | 5 | ↓ |