In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 16 | No |
Popular Name: N-[[1-[(3R)-1,1-dioxothiolan-3-yl]tetrazol-5-yl]methyl]ethanamine N-[[1-[(3R)-1,1-dioxothiolan-3-y…
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) | -1.12 | 0.06 | -67.27 | 2 | 7 | 1 | 94 | 246.316 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.12 | -1.29 | -16.53 | 1 | 7 | 0 | 90 | 245.308 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.