In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 18th, 2011 | 23 | No |
Popular Name: 1-[(3S)-5-(2-furyl)-3-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-[methyl(propyl)amino]ethanone 1-[(3S)-5-(2-furyl)-3-(2-thienyl…
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) | 2.95 | 9.22 | -33.97 | 1 | 5 | 1 | 50 | 332.449 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.95 | 6.96 | -9.07 | 0 | 5 | 0 | 49 | 331.441 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.