In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 18 | No |
Popular Name: N-[[1-[(3R)-3-methyl-1,1-dioxo-thiolan-3-yl]tetrazol-5-yl]methyl]propan-1-amine N-[[1-[(3R)-3-methyl-1,1-dioxo-t…
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) | -0.17 | 0.93 | -71.92 | 2 | 7 | 1 | 94 | 274.37 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.17 | -0.1 | -18.43 | 1 | 7 | 0 | 90 | 273.362 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.