| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2008 | 12 | Yes |
Popular Name: 3-{[(5-methyl-1,3-thiazol-2-yl)methyl]amino}propan-1-ol dihydrochloride 3-{[(5-methyl-1,3-thiazol-2-yl)m…
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CAS Numbers: , 1332531-06-2 , 920460-93-1
1-propanol, 3-[[(5-methyl-2-thiazolyl)methyl]amino]-, dihydrochloride
3-{[(5-Methyl-1,3-thiazol-2-yl)methyl]-amino}propan-1-ol dihydrochloride
| 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) | 0.02 | 0.7 | -42.36 | 3 | 3 | 1 | 50 | 187.288 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.02 | -0.74 | -7.46 | 2 | 3 | 0 | 45 | 186.28 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.