UCSF

ZINC40344836

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2010 32 Yes

Popular Name: (4S)-4-(4-chlorophenyl)-5-(3-imidazol-1-ylpropyl)-3-(4-methoxyphenyl)-1,4-dihydropyrrolo[3,4-c]pyraz (4S)-4-(4-chlorophenyl)-5-(3-imi…

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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) 3.70 12.88 -43.2 2 7 1 77 448.934 7 ↓
Mid Mid (pH 6-8) 3.70 12.37 -19.97 1 7 0 76 447.926 7 ↓

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

No pre-computed analogs available. Try a structural similarity search.