In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 37 | 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) | 4.42 | 11.79 | -40.7 | 4 | 6 | 1 | 93 | 505.658 | 12 | ↓ |
Mid Mid (pH 6-8) | 4.42 | 10.49 | -23.69 | 3 | 6 | 0 | 88 | 504.65 | 12 | ↓ |