UCSF

ZINC22749302

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 32 Yes

Popular Name: 3-[3-cyclopropyl-5-[2-oxo-2-[[4-(4-propylphenyl)thiazol-2-yl]amino]ethyl]sulfanyl-1,2,4-triazol-4-yl 3-[3-cyclopropyl-5-[2-oxo-2-[[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) 2.67 10.08 -20.42 3 8 0 116 470.624 11 ↓
Hi High (pH 8-9.5) 2.85 9.01 -51.53 2 8 -1 122 469.616 11 ↓

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Rings

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

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