In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 21 | 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) | 3.84 | 4.93 | -8.08 | 0 | 4 | 0 | 41 | 351.299 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.84 | 7.14 | -43.83 | 1 | 4 | 1 | 42 | 352.307 | 5 | ↓ |