In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 18 | Yes |
Popular Name: (1R)-1-(3,4-difluorophenyl)-N-methyl-N-[(1R)-1-methylbutyl]ethane-1,2-diamine (1R)-1-(3,4-difluorophenyl)-N-me…
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) | 2.75 | 6.89 | -134.18 | 4 | 2 | 2 | 32 | 258.356 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 6.61 | -38.68 | 3 | 2 | 1 | 30 | 257.348 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.75 | 5.31 | -51.69 | 3 | 2 | 1 | 31 | 257.348 | 6 | ↓ |