| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 22nd, 2011 | 17 | No |
Popular Name: 5-isopropylsulfanyl-N-[(E)-2-thienylmethyleneamino]-4H-1,2,4-triazol-3-amine 5-isopropylsulfanyl-N-[(E)-2-thi…
| 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) | 2.56 | 8.42 | -14.19 | 2 | 5 | 0 | 66 | 267.383 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.56 | 7.92 | -49.08 | 1 | 5 | -1 | 64 | 266.375 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
