| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 14 | No |
Popular Name: N-[(4-bromothiophen-2-yl)methyl]thian-4-amine N-[(4-bromothiophen-2-yl)methyl]…
Find On: PubMed — Wikipedia — Google
CAS Number: 1342695-57-1
| 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) | 3.05 | 7.07 | -45.32 | 2 | 1 | 1 | 17 | 293.275 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.05 | 5.88 | -3.02 | 1 | 1 | 0 | 12 | 292.267 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
