UCSF

ZINC13571261

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 22nd, 2008 27 No

Popular Name: (4E,5R)-5-(3,4-dichlorophenyl)-1-(2-dimethylaminoethyl)-4-(2-furyl-hydroxy-methylene)pyrrolidine-2,3 (4E,5R)-5-(3,4-dichlorophenyl)-1…

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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) 2.95 9.16 -72.32 1 6 0 78 409.269 6 ↓
Hi High (pH 8-9.5) 2.95 6.63 -56.87 0 6 -1 77 408.261 6 ↓
Mid Mid (pH 6-8) 3.40 8.79 -48.62 2 6 1 75 410.277 5 ↓
Mid Mid (pH 6-8) 2.37 9.94 -49.89 1 6 1 72 410.277 6 ↓

Activity (Go SEA)

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