In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 11 | Yes |
Popular Name: 1,3-Benzenedimethanamine, 2-fluoro- (9CI) 1,3-Benzenedimethanamine, 2-fluo…
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CAS Number: 198834-14-9
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) | 0.37 | 0.56 | -96.63 | 6 | 2 | 2 | 55 | 156.204 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.37 | 0.16 | -41.26 | 5 | 2 | 1 | 54 | 155.196 | 2 | ↓ |