In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 14 | Yes |
None
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) | 1.78 | 4.73 | -23.75 | 4 | 3 | 1 | 52 | 192.286 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 4.41 | -4.96 | 3 | 3 | 0 | 51 | 191.278 | 2 | ↓ |