In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 18 | Yes |
Popular Name: (3S)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]tetrahydrofuran-3-carboxamide (3S)-N-[5-(1-ethylpropyl)-1,3,4-…
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) | 1.78 | 4.37 | -16.04 | 1 | 5 | 0 | 64 | 269.37 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.96 | 3.22 | -46.39 | 0 | 5 | -1 | 70 | 268.362 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.