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) | 1.75 | 3.64 | -38.52 | 3 | 2 | 1 | 37 | 192.282 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.75 | 2.3 | -5.93 | 2 | 2 | 0 | 32 | 191.274 | 2 | ↓ |