| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 5th, 2011 | 18 | No |
Popular Name: (2S)-N-[2-(4-cyclopropyl-5-sulfanyl-1,2,4-triazol-3-yl)ethyl]-2-methyl-butanamide (2S)-N-[2-(4-cyclopropyl-5-sulfa…
| 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) | 0.83 | 6.31 | -19.45 | 2 | 5 | 0 | 63 | 268.386 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 6.24 | -51.81 | 1 | 5 | -1 | 60 | 267.378 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
