In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 19 | Yes |
Popular Name: (1R)-N-[(5-chloro-2-thienyl)methyl]-1-(4-fluorophenyl)-2-methyl-propan-1-amine (1R)-N-[(5-chloro-2-thienyl)meth…
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) | 5.07 | 9.88 | -45.1 | 2 | 1 | 1 | 17 | 298.834 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.07 | 8.64 | -3.76 | 1 | 1 | 0 | 12 | 297.826 | 5 | ↓ |