| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2011 | 21 | No |
Popular Name: (3S)-3-(2-bromophenyl)-4-[(E)-4-pyridylmethyleneamino]-3H-1,2,4-triazole-5-thione (3S)-3-(2-bromophenyl)-4-[(E)-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) | 2.96 | 7.32 | -31.01 | 1 | 5 | 1 | 55 | 361.248 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
