In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2006 | 14 | No |
Popular Name: [(3-nitrophenyl)methyl](prop-2-en-1-yl)amine hydrochloride [(3-nitrophenyl)methyl](prop-2-e…
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CAS Numbers: 1158745-18-6 , 893590-94-8
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) | 2.08 | 1.01 | -51.81 | 2 | 4 | 1 | 62 | 193.226 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 215 - 217 | Enamine Building Blocks |
MP | 215...217 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |