| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 12 | Yes |
Popular Name: (2-tert-butylphenyl)methanamine (2-tert-butylphenyl)methanamine
Find On: PubMed — Wikipedia — Google
CAS Number: 91338-95-3
| 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) | 2.78 | 4.91 | -40.1 | 3 | 1 | 1 | 28 | 164.272 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 4.41 | -2.11 | 2 | 1 | 0 | 26 | 163.264 | 2 | ↓ |
| 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.
