In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2011 | 21 | Yes |
Popular Name: (1R)-1-[3-bromo-4-[(1R)-tetralin-1-yl]oxy-phenyl]ethanamine (1R)-1-[3-bromo-4-[(1R)-tetralin…
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) | 2.96 | 8.67 | -49.85 | 3 | 2 | 1 | 37 | 347.276 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.96 | 8.38 | -4.4 | 2 | 2 | 0 | 35 | 346.268 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.