In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 14 | Yes |
Popular Name: 1-(5-bromo-2-thienyl)-N-[[(3S)-tetrahydrofuran-3-yl]methyl]methanamine 1-(5-bromo-2-thienyl)-N-[[(3S)-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) | 2.82 | 5.22 | -46.71 | 2 | 2 | 1 | 26 | 277.207 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.82 | 3.89 | -4.01 | 1 | 2 | 0 | 21 | 276.199 | 4 | ↓ |