| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2009 | 14 | Yes |
Popular Name: 2-Amino-1-[4-(2-hydroxyethyl)-1-piperazinyl]-1-propanone hydrochloride 2-Amino-1-[4-(2-hydroxyethyl)-1-…
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CAS Numbers: 1236258-06-2 , N/A , [1236258-06-2]
2-Amino-1-(4-(2-hydroxyethyl)piperazin-1-yl)propan-1-one hydrochloride
2-amino-1-[4-(2-hydroxyethyl)-1-piperazinyl]-1-propanonehydrochloride
| 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) | -1.87 | -3.44 | -44.85 | 4 | 5 | 1 | 71 | 202.278 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.87 | -3.77 | -9.13 | 3 | 5 | 0 | 70 | 201.27 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -1.87 | -1.13 | -95.95 | 5 | 5 | 2 | 73 | 203.286 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.