In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 35 | 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) | 0.58 | 7.81 | -24.04 | 1 | 10 | 0 | 112 | 501.609 | 9 | ↓ |
Hi High (pH 8-9.5) | 0.40 | 6.64 | -59.03 | 0 | 10 | -1 | 118 | 500.601 | 9 | ↓ |