In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2010 | 16 | 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) | 1.99 | 4.44 | -43.41 | 3 | 2 | 1 | 31 | 219.352 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.99 | 6.78 | -111.75 | 4 | 2 | 2 | 32 | 220.36 | 4 | ↓ |