| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2010 | 18 | No |
Popular Name: (1S)-N-[(3-nitrophenyl)methyl]-1-(2H-tetrazol-5-yl)ethanamine (1S)-N-[(3-nitrophenyl)methyl]-1…
| 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) | 0.81 | 3.96 | -47.93 | 2 | 8 | 0 | 115 | 248.246 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.81 | 2.69 | -39.12 | 1 | 8 | -1 | 111 | 247.238 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.