In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 19 | Yes |
Popular Name: (1S)-1-(5-bromo-2-thienyl)-N-[(R)-cyclopropyl(phenyl)methyl]ethanamine (1S)-1-(5-bromo-2-thienyl)-N-[(R…
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) | 5.34 | 10.56 | -37.96 | 2 | 1 | 1 | 17 | 337.306 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.34 | 9.59 | -2.09 | 1 | 1 | 0 | 12 | 336.298 | 5 | ↓ |