In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 13 | Yes |
Popular Name: 2-(oxolan-3-yl)-2-(pyrrolidin-1-yl)ethan-1-amine 2-(oxolan-3-yl)-2-(pyrrolidin-1-…
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CAS Number: 953886-65-2
None
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 | 0.22 | -46.3 | 3 | 3 | 1 | 40 | 185.291 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.02 | 0.35 | -2.19 | 2 | 3 | 0 | 38 | 184.283 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.02 | 2.58 | -33.02 | 3 | 3 | 1 | 40 | 185.291 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.02 | 2.62 | -115.89 | 4 | 3 | 2 | 41 | 186.299 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |