In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 15 | Yes |
Popular Name: [3-(dimethylamino)-2,2-dimethylpropyl](thiophen-2-ylmethyl)amine [3-(dimethylamino)-2,2-dimethylp…
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CAS Number: 1019504-60-9
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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) | 2.58 | 7.83 | -98.7 | 3 | 2 | 2 | 21 | 228.405 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 6.64 | -33.57 | 2 | 2 | 1 | 16 | 227.397 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |