In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2010 | 18 | Yes |
Popular Name: (1S)-N-methyl-1-[3-(3,4,5-trifluorophenyl)-1,2,4-oxadiazol-5-yl]ethanamine (1S)-N-methyl-1-[3-(3,4,5-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) | 2.51 | 3.58 | -46.37 | 2 | 4 | 1 | 56 | 258.223 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.51 | 2.28 | -4.42 | 1 | 4 | 0 | 51 | 257.215 | 3 | ↓ |