In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 18 | Yes |
Popular Name: N-[(5-bromo-2-thienyl)methyl]-3-[[(2S)-tetrahydrofuran-2-yl]methoxy]propan-1-amine N-[(5-bromo-2-thienyl)methyl]-3-…
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) | 2.96 | 6.34 | -47.16 | 2 | 3 | 1 | 35 | 335.287 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.96 | 4.92 | -6.73 | 1 | 3 | 0 | 30 | 334.279 | 8 | ↓ |