In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2008 | 14 | Yes |
Popular Name: methyl 2-[3-(aminomethyl)phenoxy]acetate hydrochloride methyl 2-[3-(aminomethyl)phenoxy…
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CAS Numbers: 869296-24-2 , 869333-27-7
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) | 1.02 | 3.42 | -49.97 | 3 | 4 | 1 | 63 | 196.226 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.02 | 3.03 | -10.31 | 2 | 4 | 0 | 62 | 195.218 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 114 - 116 | Enamine Building Blocks |
MP | 114...116 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |