In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2012 | 21 | 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) | 1.85 | 7.54 | -10.95 | 0 | 4 | 0 | 42 | 284.359 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.85 | 8 | -38.59 | 1 | 4 | 1 | 44 | 285.367 | 6 | ↓ |