In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 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) | 6.31 | 19.15 | -113.5 | 2 | 5 | 2 | 30 | 507.742 | 10 | ↓ |
Mid Mid (pH 6-8) | 6.31 | 17.23 | -36.57 | 1 | 5 | 1 | 29 | 506.734 | 10 | ↓ |