| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2008 | 11 | Yes |
Popular Name: 4-chloro-2-[(methylamino)methyl]phenol 4-chloro-2-[(methylamino)methyl]…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 189337-28-8 , 38926-77-1
| 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) | 2.09 | 2.14 | -39.16 | 3 | 2 | 1 | 37 | 172.635 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.09 | 2.92 | -31.29 | 2 | 2 | 0 | 40 | 171.627 | 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.