In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 14 | 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 | 0.97 | -38.42 | 3 | 4 | 1 | 51 | 200.306 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.12 | -1.41 | -9.87 | 2 | 4 | 0 | 50 | 199.298 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.12 | 0.96 | -40.15 | 3 | 4 | 1 | 51 | 200.306 | 5 | ↓ |