In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2010 | 19 | Yes |
Popular Name: (1R)-2-[(5-bromo-2-fluoro-phenyl)methyl]-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine (1R)-2-[(5-bromo-2-fluoro-phenyl…
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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) | 3.68 | 10.38 | -37 | 1 | 2 | 1 | 9 | 324.217 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.68 | 8.26 | -4.9 | 0 | 2 | 0 | 8 | 323.209 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.