In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 21 | Yes |
Popular Name: (1R,2S)-1-(4-methoxyphenyl)-1-(4-methylphenoxy)butan-2-amine (1R,2S)-1-(4-methoxyphenyl)-1-(4…
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) | 3.82 | 7.02 | -47.52 | 3 | 3 | 1 | 46 | 286.395 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.82 | 7.06 | -4.76 | 2 | 3 | 0 | 44 | 285.387 | 6 | ↓ |