In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 20 | 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) | -0.42 | -1.64 | -13.53 | 4 | 7 | 0 | 111 | 279.227 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.23 | -4.22 | -41.82 | 3 | 7 | -1 | 117 | 278.219 | 1 | ↓ |