In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2010 | 13 | Yes |
Popular Name: (1-methoxy-3-phenylpropan-2-yl)(methyl)amine hydrochloride (1-methoxy-3-phenylpropan-2-yl)(…
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CAS Number: 91339-68-3
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) | 1.87 | 4.59 | -33.87 | 2 | 2 | 1 | 26 | 180.271 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.87 | 3.18 | -3.41 | 1 | 2 | 0 | 21 | 179.263 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |