| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 15 | Yes |
Popular Name: (2S)-2-amino-2-cyclopropyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanenitrile (2S)-2-amino-2-cyclopropyl-3-[(5…
| 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) | 1.09 | 2.63 | -10.3 | 2 | 4 | 0 | 76 | 240.357 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.09 | 2.93 | -51.96 | 3 | 4 | 1 | 77 | 241.365 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
