In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (1R)-1-(4-fluorophenyl)-N-methyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]ethane-1,2-diamine (1R)-1-(4-fluorophenyl)-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) | 1.27 | 3.76 | -52.84 | 3 | 3 | 1 | 40 | 253.341 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.27 | 5.8 | -121.31 | 4 | 3 | 2 | 41 | 254.349 | 5 | ↓ |