In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 12 | 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) | -0.12 | -1.07 | -35.06 | 4 | 4 | 1 | 64 | 172.252 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.12 | 1.12 | -101.35 | 5 | 4 | 2 | 65 | 173.26 | 3 | ↓ |