In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 15 | Yes |
Popular Name: N-[(1S)-1-(5-bromo-2-thienyl)ethyl]tetrahydropyran-4-amine N-[(1S)-1-(5-bromo-2-thienyl)eth…
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) | 3.26 | 5.65 | -39.5 | 2 | 2 | 1 | 26 | 291.234 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.26 | 4.63 | -2.54 | 1 | 2 | 0 | 21 | 290.226 | 3 | ↓ |