In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 32 | 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) | 3.01 | 10.23 | -20.92 | 0 | 6 | 0 | 53 | 435.568 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.01 | 12.64 | -60.77 | 1 | 6 | 1 | 54 | 436.576 | 5 | ↓ |