In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: (1R)-N-isobutyl-N-methyl-1-[2-(trifluoromethyl)phenyl]ethane-1,2-diamine (1R)-N-isobutyl-N-methyl-1-[2-(t…
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) | 2.70 | 5.43 | -41.45 | 3 | 2 | 1 | 31 | 275.338 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.70 | 7.53 | -118.65 | 4 | 2 | 2 | 32 | 276.346 | 6 | ↓ |