In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2009 | 15 | Yes |
Popular Name: 3-amino-2-[(dimethylamino)methyl]-1-phenylpropan-1-ol 3-amino-2-[(dimethylamino)methyl…
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CAS Number: 1087784-24-4
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) | 0.33 | 3.17 | -100.45 | 5 | 3 | 2 | 52 | 210.321 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.33 | 1 | -34.86 | 4 | 3 | 1 | 51 | 209.313 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |