In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 18 | 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) | 2.90 | 6.91 | -7.8 | 1 | 2 | 0 | 33 | 241.334 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.90 | 7.37 | -34.36 | 2 | 2 | 1 | 34 | 242.342 | 5 | ↓ |