In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 28 | 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) | 3.85 | 8.97 | -14.06 | 1 | 6 | 0 | 70 | 380.444 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.85 | 9.39 | -45.03 | 2 | 6 | 1 | 71 | 381.452 | 8 | ↓ |