In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 24th, 2010 | 21 | Yes |
Popular Name: (1S)-1-(5-methyl-2-thienyl)-N-[[2-(trifluoromethoxy)phenyl]methyl]ethanamine (1S)-1-(5-methyl-2-thienyl)-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) | 4.50 | 8.59 | -37.35 | 2 | 2 | 1 | 26 | 316.368 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.50 | 7.34 | -4.42 | 1 | 2 | 0 | 21 | 315.36 | 6 | ↓ |