In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 12 | 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) | -2.28 | -3.85 | -50.54 | 5 | 5 | 1 | 86 | 172.208 | 4 | ↓ |
Mid Mid (pH 6-8) | -2.10 | -5.06 | -94.22 | 5 | 5 | 1 | 97 | 172.208 | 4 | ↓ |