In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 27 | 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) | 1.22 | 5.97 | -12.75 | 1 | 8 | 0 | 85 | 408.553 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.22 | 8.21 | -48.9 | 2 | 8 | 1 | 86 | 409.561 | 8 | ↓ |