In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2009 | 18 | Yes |
Popular Name: 2-(benzylamino)-1-(3-chlorophenyl)ethan-1-ol 2-(benzylamino)-1-(3-chloropheny…
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CAS Number: 93946-44-2
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) | 2.96 | 4.81 | -6.44 | 2 | 2 | 0 | 32 | 261.752 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.96 | 6.32 | -44.03 | 3 | 2 | 1 | 37 | 262.76 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 79 - 81 | Enamine Building Blocks |
MP | 79...81 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |