In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 21 | Yes |
Popular Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-2-(1H-indol-3-yl)ethanamine N-[(5-bromo-2-fluoro-phenyl)meth…
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) | 4.35 | 8.3 | -8.1 | 2 | 2 | 0 | 28 | 347.231 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.35 | 9.72 | -45.61 | 3 | 2 | 1 | 32 | 348.239 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.