In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2005 | 22 | Yes |
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) | 4.12 | 0.22 | -11.19 | 1 | 4 | 0 | 42 | 295.386 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.38 | 0.4 | -25.29 | 2 | 4 | 1 | 45 | 296.394 | 3 | ↓ |