In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 23 | Yes |
Popular Name: (3S)-4-(2-ethoxyphenyl)-3-(1-ethyl-3-methyl-pyrazol-4-yl)-3H-1,2,4-triazol-5-one (3S)-4-(2-ethoxyphenyl)-3-(1-eth…
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) | 2.06 | 7.2 | -14.72 | 1 | 7 | 0 | 78 | 313.361 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.