In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 15 | Yes |
Popular Name: 1-(3-bromo-2-thienyl)-N-[[(2R)-tetrahydropyran-2-yl]methyl]methanamine 1-(3-bromo-2-thienyl)-N-[[(2R)-t…
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) | 3.01 | 6.11 | -35.87 | 2 | 2 | 1 | 26 | 291.234 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.01 | 4.75 | -2.99 | 1 | 2 | 0 | 21 | 290.226 | 4 | ↓ |