In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2009 | 19 | Yes |
Popular Name: (1R)-1-(3-bromophenyl)-2-[[(2R)-1-ethylpyrrolidin-2-yl]methylamino]ethanol (1R)-1-(3-bromophenyl)-2-[[(2R)-…
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) | 2.14 | 6.92 | -119.66 | 4 | 3 | 2 | 41 | 329.282 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.14 | 3.39 | -3.85 | 2 | 3 | 0 | 35 | 327.266 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.14 | 5.64 | -30.91 | 3 | 3 | 1 | 37 | 328.274 | 6 | ↓ |