In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 15 | Yes |
Popular Name: N-[2-[[(1R)-1-(5-bromo-2-thienyl)ethyl]amino]ethyl]acetamide N-[2-[[(1R)-1-(5-bromo-2-thienyl…
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) | 2.03 | 3.95 | -49.39 | 3 | 3 | 1 | 46 | 292.222 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 2.77 | -10.1 | 2 | 3 | 0 | 41 | 291.214 | 5 | ↓ |