In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2009 | 35 | 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) | 0.17 | 3.03 | -22.95 | 3 | 15 | 0 | 185 | 485.461 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.17 | 5.37 | -59.36 | 4 | 15 | 1 | 186 | 486.469 | 9 | ↓ |