In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (1R)-1-(2-bromophenyl)-N-methyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]ethane-1,2-diamine (1R)-1-(2-bromophenyl)-N-methyl-…
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) | 1.86 | 4.49 | -35.33 | 3 | 3 | 1 | 40 | 314.247 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.86 | 6.12 | -111.87 | 4 | 3 | 2 | 41 | 315.255 | 5 | ↓ |