In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 17 | 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) | 1.41 | 6.1 | -49.66 | 2 | 3 | 1 | 37 | 277.479 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 4.78 | -9.01 | 1 | 3 | 0 | 32 | 276.471 | 7 | ↓ |