| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2010 | 20 | Yes |
Popular Name: (2S)-2-methyl-2-(methylamino)-4-(1-phenyltetrazol-5-yl)sulfanyl-butanenitrile (2S)-2-methyl-2-(methylamino)-4-…
| 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) | 1.79 | 4.77 | -14.27 | 1 | 6 | 0 | 79 | 288.38 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 6.06 | -61.19 | 2 | 6 | 1 | 84 | 289.388 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
