In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | No |
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) | 2.46 | 6.11 | -38.63 | 2 | 3 | 1 | 37 | 269.434 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 5.04 | -8.05 | 1 | 3 | 0 | 32 | 268.426 | 1 | ↓ |