In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 15 | Yes |
Popular Name: N1-(5-bromo-2-fluorobenzyl)-N2,N2-dimethylethane-1,2-diamine N1-(5-bromo-2-fluorobenzyl)-N2,N…
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CAS Number: 926220-40-8
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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) | 2.43 | 4.77 | -39.58 | 2 | 2 | 1 | 20 | 276.173 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.43 | 3.34 | -2.53 | 1 | 2 | 0 | 15 | 275.165 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.43 | 5.89 | -35.66 | 2 | 2 | 1 | 16 | 276.173 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.43 | 7.19 | -112.07 | 3 | 2 | 2 | 21 | 277.181 | 5 | ↓ |