In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 14 | Yes |
Popular Name: methyl 2-{[(2-chlorophenyl)methyl]amino}acetate methyl 2-{[(2-chlorophenyl)methy…
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CAS Numbers: 1181457-90-8 , 133486-56-3
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) | 1.99 | 5.92 | -40.57 | 2 | 3 | 1 | 43 | 214.672 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.99 | 4.47 | -7.29 | 1 | 3 | 0 | 38 | 213.664 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 121 - 123 | Enamine Building Blocks |
MP | 121...123 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |