In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2011 | 20 | Yes |
Popular Name: (2R)-2-(ethylamino)-4-(4-phenylpyrazol-1-yl)butanamide (2R)-2-(ethylamino)-4-(4-phenylp…
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) | 1.82 | 4.27 | -48.54 | 4 | 5 | 1 | 78 | 273.36 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.82 | 3.25 | -10.06 | 3 | 5 | 0 | 73 | 272.352 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.