UCSF

ZINC35282350

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2009 30 No

Popular Name: (4E,5R)-5-(4-bromophenyl)-1-(2-dimethylaminoethyl)-4-[(3-ethoxyphenyl)-hydroxy-methylene]pyrrolidine (4E,5R)-5-(4-bromophenyl)-1-(2-d…

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Physical Representations

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) 3.63 10.2 -71.2 1 6 0 74 473.367 8 ↓
Lo Low (pH 4.5-6) 3.63 9.44 -51.6 2 6 1 71 474.375 8 ↓

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )