In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 21 | Yes |
Popular Name: (1R)-N-methyl-N-[(1R)-1-methylbutyl]-1-[2-(trifluoromethoxy)phenyl]ethane-1,2-diamine (1R)-N-methyl-N-[(1R)-1-methylbu…
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) | 3.42 | 6.48 | -119.31 | 4 | 3 | 2 | 41 | 306.372 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.42 | 6.12 | -33 | 3 | 3 | 1 | 40 | 305.364 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 4.75 | -41.77 | 3 | 3 | 1 | 40 | 305.364 | 8 | ↓ |