In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 3rd, 2006 | 29 | No |
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) | 4.24 | 6.76 | -8.91 | 3 | 5 | 0 | 88 | 396.372 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.24 | 7 | -59.3 | 4 | 5 | 1 | 89 | 397.38 | 3 | ↓ |