In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 22 | Yes |
Popular Name: 5-bromo-2-chloro-N-[[(3S)-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]benzamide 5-bromo-2-chloro-N-[[(3S)-1-(2,2…
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) | 4.00 | 8.12 | -46.4 | 2 | 3 | 1 | 34 | 400.646 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.00 | 5.79 | -8.41 | 1 | 3 | 0 | 32 | 399.638 | 5 | ↓ |