In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 3-bromo-N-[[(3S)-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]benzamide 3-bromo-N-[[(3S)-1-(2,2,2-triflu…
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) | 3.37 | 7.61 | -45.7 | 2 | 3 | 1 | 34 | 366.201 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.37 | 5.28 | -7.98 | 1 | 3 | 0 | 32 | 365.193 | 5 | ↓ |