In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: (1S)-1-(2,5-difluorophenyl)-N-[(1R)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]ethanamine (1S)-1-(2,5-difluorophenyl)-N-[(…
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) | 1.90 | 8.23 | -45.17 | 2 | 4 | 1 | 47 | 267.303 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.90 | 7.22 | -10.39 | 1 | 4 | 0 | 43 | 266.295 | 4 | ↓ |