In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: N-[(5-bromo-2-thienyl)methyl]-1-(4-chloro-3-fluoro-phenyl)methanamine N-[(5-bromo-2-thienyl)methyl]-1-…
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 | 8.67 | -55.46 | 2 | 1 | 1 | 17 | 335.649 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.50 | 7.32 | -5.18 | 1 | 1 | 0 | 12 | 334.641 | 4 | ↓ |