In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2010 | 16 | Yes |
None
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) | 0.93 | 3.54 | -39.95 | 2 | 4 | 1 | 37 | 228.36 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.93 | 1.28 | -6.2 | 1 | 4 | 0 | 36 | 227.352 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.93 | 3.29 | -39.93 | 2 | 4 | 1 | 37 | 228.36 | 5 | ↓ |