In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 21 | No |
Popular Name: N-[[5-(3-fluoro-4-nitro-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]methanamine N-[[5-(3-fluoro-4-nitro-phenoxy)…
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) | 2.02 | 5.68 | -48.76 | 2 | 7 | 1 | 89 | 295.294 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.02 | 4.24 | -7.77 | 1 | 7 | 0 | 85 | 294.286 | 5 | ↓ |