In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2011 | 20 | Yes |
Popular Name: N3-[2-fluoro-5-(trifluoromethyl)phenyl]-2,5-dimethyl-pyrazole-3,4-diamine N3-[2-fluoro-5-(trifluoromethyl)…
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) | 3.12 | 4.89 | -5.88 | 3 | 4 | 0 | 56 | 288.248 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 5.01 | -28.28 | 4 | 4 | 1 | 57 | 289.256 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.