In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 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) | -2.74 | 2.21 | -74.4 | 4 | 5 | 1 | 75 | 202.278 | 4 | ↓ |
Hi High (pH 8-9.5) | -2.74 | -0.74 | -41.63 | 2 | 5 | -1 | 73 | 200.262 | 4 | ↓ |