UCSF

ZINC22749294

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 31 Yes

Popular Name: 3-[3-cyclopropyl-5-[2-[[4-(3,4-dimethylphenyl)thiazol-2-yl]amino]-2-oxo-ethyl]sulfanyl-1,2,4-triazol 3-[3-cyclopropyl-5-[2-[[4-(3,4-d…

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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) 2.19 9.2 -21.03 3 8 0 116 456.597 9 ↓
Hi High (pH 8-9.5) 2.37 8.14 -52.77 2 8 -1 122 455.589 9 ↓

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Rings

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

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