In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 13 | Yes |
Popular Name: methyl 1-amino-4-ethylcyclohexane-1-carboxylate methyl 1-amino-4-ethylcyclohexan…
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CAS Number: 1094555-70-0
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) | 2.02 | 4.13 | -42.52 | 3 | 3 | 1 | 54 | 186.275 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 3.86 | -4.66 | 2 | 3 | 0 | 52 | 185.267 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |