UCSF

ZINC34919640

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 38 No

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

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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) 6.30 14.42 -58.27 0 6 -1 79 512.626 12 ↓
Lo Low (pH 4.5-6) 6.30 13.67 -12.29 1 6 0 76 513.634 12 ↓

Activity (Go SEA)

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