UCSF

ZINC34940980

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 36 No

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

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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) 3.36 7.55 -63.59 0 8 -1 91 491.564 11 ↓
Mid Mid (pH 6-8) 3.36 9.82 -72.44 1 8 0 93 492.572 11 ↓
Lo Low (pH 4.5-6) 3.36 9.08 -53.31 2 8 1 90 493.58 11 ↓

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