| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2010 | 17 | No |
Popular Name: (1S)-3-methylsulfanyl-1-[2-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]propan-1-amine (1S)-3-methylsulfanyl-1-[2-methy…
| 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) | -0.25 | 5.27 | -53.64 | 3 | 4 | 1 | 58 | 269.419 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.25 | 4.96 | -10.55 | 2 | 4 | 0 | 57 | 268.411 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
