In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 13 | Yes |
Popular Name: [(1-ethylpyrrolidin-2-yl)methyl](2-methylpropyl)amine [(1-ethylpyrrolidin-2-yl)methyl]…
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CAS Number: 1021097-33-5
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) | 1.67 | 7.21 | -112.06 | 3 | 2 | 2 | 21 | 186.343 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.67 | 5.06 | -34.39 | 2 | 2 | 1 | 20 | 185.335 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |