UCSF

ZINC67076570

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2011 24 No

Popular Name: N-[2-(4-ethyl-5-sulfanyl-1,2,4-triazol-3-yl)ethyl]-3-methylsulfanyl-imidazo[1,5-a]pyridine-1-carboxa N-[2-(4-ethyl-5-sulfanyl-1,2,4-t…

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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) 1.25 8.57 -22.18 2 7 0 80 362.484 6 ↓
Mid Mid (pH 6-8) 1.98 8.35 -56.44 1 7 -1 77 361.476 6 ↓

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

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