In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 32 | 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) | 3.83 | 10.95 | -15.32 | 1 | 5 | 0 | 48 | 430.527 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.83 | 11.3 | -42.81 | 2 | 5 | 1 | 50 | 431.535 | 5 | ↓ |