In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 34 | 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) | 2.97 | 10.27 | -23.78 | 0 | 7 | 0 | 62 | 465.594 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.97 | 12.56 | -59.59 | 1 | 7 | 1 | 64 | 466.602 | 8 | ↓ |