In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 15 | Yes |
None
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) | 0.35 | 3.58 | -83.98 | 4 | 3 | 2 | 35 | 213.369 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.35 | 1.14 | -43.52 | 3 | 3 | 1 | 34 | 212.361 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.35 | 3.36 | -98.53 | 4 | 3 | 2 | 35 | 213.369 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.35 | 5.81 | -183.22 | 5 | 3 | 3 | 37 | 214.377 | 4 | ↓ |