In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2009 | 30 | 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) | 3.50 | 9.3 | -9.21 | 0 | 5 | 0 | 36 | 427.976 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.50 | 11.31 | -47.93 | 1 | 5 | 1 | 37 | 428.984 | 4 | ↓ |