In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 16 | Yes |
Popular Name: (1R)-N-[(5-bromo-2-thienyl)methyl]-1-(3-pyridyl)ethanamine (1R)-N-[(5-bromo-2-thienyl)methy…
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) | 3.05 | 7.04 | -47.29 | 2 | 2 | 1 | 29 | 298.229 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 5.8 | -5.26 | 1 | 2 | 0 | 25 | 297.221 | 4 | ↓ |