| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2010 | 16 | Yes |
Popular Name: (2S)-2-amino-3-(1,3-benzoxazol-2-ylsulfanyl)-2-methyl-propanenitrile (2S)-2-amino-3-(1,3-benzoxazol-2…
| 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) | 2.08 | 1.36 | -10.54 | 2 | 4 | 0 | 76 | 233.296 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.08 | 1.64 | -53.25 | 3 | 4 | 1 | 77 | 234.304 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
