| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 21 | Yes |
Popular Name: (2S)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methoxypropyl)propan-1-amine (2S)-2-[(4,5-dicyclopropyl-1,2,4…
| 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) | 1.25 | 8.72 | -48.63 | 2 | 5 | 1 | 57 | 311.475 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 7.37 | -11.5 | 1 | 5 | 0 | 52 | 310.467 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
