In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 17 | 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) | 1.74 | 5.23 | -31.76 | 3 | 3 | 1 | 34 | 234.367 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.74 | 5.16 | -33.09 | 3 | 3 | 1 | 34 | 234.367 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.74 | 3.03 | -2.48 | 2 | 3 | 0 | 32 | 233.359 | 3 | ↓ |