In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 33 | 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) | 5.09 | 12.04 | -12.84 | 1 | 6 | 0 | 56 | 491.463 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.09 | 14.25 | -50.62 | 2 | 6 | 1 | 57 | 492.471 | 8 | ↓ |