UCSF

ZINC55158096

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2010 30 Yes

Popular Name: (5E,9S)-9-(4-methoxyphenyl)-5-[(4-methoxyphenyl)methylene]-6,7,8,9-tetrahydro-4H-[1,2,4]triazolo[5,1 (5E,9S)-9-(4-methoxyphenyl)-5-[(…

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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) 4.91 13.28 -10.55 1 6 0 63 401.49 4 ↓
Mid Mid (pH 6-8) 4.96 13.86 -11.21 1 6 0 61 400.482 4 ↓

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Rings

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

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