In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 16 | Yes |
Popular Name: (1R)-1-(5-bromo-2-thienyl)-N-[[(2S)-tetrahydropyran-2-yl]methyl]ethanamine (1R)-1-(5-bromo-2-thienyl)-N-[[(…
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) | 3.77 | 6.77 | -38 | 2 | 2 | 1 | 26 | 305.261 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.77 | 5.52 | -3.67 | 1 | 2 | 0 | 21 | 304.253 | 4 | ↓ |