In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 24 | 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) | 2.00 | 3.04 | -7.1 | 1 | 6 | 0 | 76 | 335.4 | 0 | ↓ |
Mid Mid (pH 6-8) | 2.00 | 6.95 | -40.75 | 2 | 6 | 1 | 77 | 336.408 | 0 | ↓ |