| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 5th, 2011 | 21 | No |
Popular Name: (3S)-N-[2-(4-cyclopropyl-5-sulfanyl-1,2,4-triazol-3-yl)ethyl]-3-ethyl-4-methyl-pentanamide (3S)-N-[2-(4-cyclopropyl-5-sulfa…
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| 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) | 2.60 | 7.98 | -19.2 | 2 | 5 | 0 | 63 | 310.467 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 7.82 | -51.31 | 1 | 5 | -1 | 60 | 309.459 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
