In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 16 | Yes |
Popular Name: (1S)-1-(5-bromo-2-thienyl)-N-(4-pyridylmethyl)ethanamine (1S)-1-(5-bromo-2-thienyl)-N-(4-…
None
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) | 3.00 | 6.86 | -47.75 | 2 | 2 | 1 | 29 | 298.229 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.00 | 5.64 | -4.93 | 1 | 2 | 0 | 25 | 297.221 | 4 | ↓ |