In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2010 | 16 | Yes |
Popular Name: 2-(3-Methyl-piperazin-1-yl)-benzooxazole hydrochloride 2-(3-Methyl-piperazin-1-yl)-benz…
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CAS Number: 1353948-40-9
2-(3-Methyl-piperazin-1-yl)-benzooxazolehydrochloride
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) | 1.93 | 3.43 | -45.98 | 2 | 4 | 1 | 46 | 218.28 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.93 | 2.19 | -7.83 | 1 | 4 | 0 | 41 | 217.272 | 1 | ↓ |