In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 15 | Yes |
Popular Name: [(5-bromothiophen-2-yl)methyl](pyridin-2-ylmethyl)amine [(5-bromothiophen-2-yl)methyl](p…
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CAS Number: 1020996-25-1
None
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) | 2.56 | 6.27 | -43.97 | 2 | 2 | 1 | 29 | 284.202 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 4.86 | -5.45 | 1 | 2 | 0 | 25 | 283.194 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |