| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2010 | 21 | Yes |
Popular Name: (2S)-2-methyl-3-(1-phenyltetrazol-5-yl)sulfanyl-2-(propylamino)propanenitrile (2S)-2-methyl-3-(1-phenyltetrazo…
| 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) | 2.39 | 5.94 | -12.06 | 1 | 6 | 0 | 79 | 302.407 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.39 | 7.1 | -54.55 | 2 | 6 | 1 | 84 | 303.415 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
