In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 14 | Yes |
Popular Name: 3-amino-3-(2,6-difluorophenyl)propanoic acid 3-amino-3-(2,6-difluorophenyl)pr…
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CAS Numbers: 1270156-95-0 , 612532-20-4
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) | -0.82 | 3.18 | -38.9 | 3 | 3 | 0 | 68 | 201.172 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.82 | 2.92 | -49 | 2 | 3 | -1 | 66 | 200.164 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |