| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 25th, 2011 | 28 | Yes |
Popular Name: 3-(3-phenoxypropylsulfanyl)-4-phenyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazole 3-(3-phenoxypropylsulfanyl)-4-ph…
| 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) | 3.92 | 14.46 | -37.03 | 1 | 5 | 1 | 44 | 395.552 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.92 | 12.05 | -10.64 | 0 | 5 | 0 | 43 | 394.544 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.