| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2010 | 19 | No |
Popular Name: (1S)-1-(4-cyclopentyl-5-methyl-1,2,4-triazol-3-yl)-3-methylsulfonyl-propan-1-amine (1S)-1-(4-cyclopentyl-5-methyl-1…
| 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) | -1.79 | 2.44 | -67.02 | 3 | 6 | 1 | 93 | 287.409 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.79 | 2.1 | -22.77 | 2 | 6 | 0 | 91 | 286.401 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
