| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 4th, 2011 | 24 | No |
Popular Name: (3S)-3-[(7aS)-2,3-dimethyl-7aH-indol-5-yl]-4-(4-bromophenyl)-3H-1,2,4-triazole-5-thione (3S)-3-[(7aS)-2,3-dimethyl-7aH-i…
| 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) | 4.96 | 7.58 | -41.75 | 1 | 4 | 1 | 42 | 400.325 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
