| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 15 | Yes |
Popular Name: (4-methoxy-4-methylpentan-2-yl)(thiophen-2-ylmethyl)amine (4-methoxy-4-methylpentan-2-yl)(…
Find On: PubMed — Wikipedia — Google
CAS Number: 1092291-86-5
| 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) | 2.79 | 6.23 | -30.08 | 2 | 2 | 1 | 26 | 228.381 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.79 | 5.34 | -2.52 | 1 | 2 | 0 | 21 | 227.373 | 6 | ↓ |
| 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.