| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2011 | 19 | Yes |
Popular Name: (2S)-N-(2,1,3-benzoxadiazol-5-ylmethyl)-1-imidazol-1-yl-propan-2-amine (2S)-N-(2,1,3-benzoxadiazol-5-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) | 1.45 | 5.9 | -47.59 | 2 | 6 | 1 | 70 | 258.305 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 5.37 | -12.3 | 1 | 6 | 0 | 69 | 257.297 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 6.63 | -65.29 | 2 | 6 | 1 | 73 | 258.305 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 7.15 | -129.3 | 3 | 6 | 2 | 75 | 259.313 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
