In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2010 | 12 | Yes |
Popular Name: (S)-1-(2,6-Difluorophenyl)propan-1-amine hydrochloride (S)-1-(2,6-Difluorophenyl)propan…
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CAS Number: 1217444-93-3
(1R)-1-(2,6-Difluorophenyl)propylamine hydrochloride
(R)-2,6-Difluoro-alpha-ethylbenzylamine hydrochloride
(S)-1-(2,6-DIFLUOROPHENYL)PROPAN-1-AMINE-HCl
1-(2,6-difluorophenyl)propan-1-amine
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) | 0.54 | 4.18 | -34.25 | 3 | 1 | 1 | 28 | 172.198 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.54 | 3.85 | -3.47 | 2 | 1 | 0 | 26 | 171.19 | 2 | ↓ |