In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 19 | Yes |
Popular Name: N-[(1R)-1-(5-bromo-2-thienyl)ethyl]-1-butyl-piperidin-4-amine N-[(1R)-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) | 4.75 | 9.01 | -36.25 | 2 | 2 | 1 | 16 | 346.358 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.75 | 10.04 | -109.37 | 3 | 2 | 2 | 21 | 347.366 | 6 | ↓ |