In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 15 | 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) | 1.47 | 2.09 | -8.03 | 2 | 3 | 0 | 41 | 204.273 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 3.43 | -47.75 | 3 | 3 | 1 | 46 | 205.281 | 1 | ↓ |