| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 6th, 2010 | 19 | Yes |
Popular Name: (3-amino-2-thienyl)-[4-(2-methoxyethyl)-1,4-diazepan-1-yl]methanone (3-amino-2-thienyl)-[4-(2-methox…
| 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) | 0.83 | 4.02 | -41.04 | 3 | 5 | 1 | 60 | 284.405 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.83 | 3.95 | -87.94 | 4 | 5 | 2 | 62 | 285.413 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
