| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 17 | No |
Popular Name: N-[[1-[(3S)-1,1-dioxothian-3-yl]tetrazol-5-yl]methyl]ethanamine N-[[1-[(3S)-1,1-dioxothian-3-yl]…
| 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) | -0.85 | 0.72 | -57.99 | 2 | 7 | 1 | 94 | 260.343 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.85 | -0.64 | -16.02 | 1 | 7 | 0 | 90 | 259.335 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
