UCSF

ZINC22754173

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: (2S)-N-(3-ethylsulfanyl-1,2,4-thiadiazol-5-yl)-2-[4-(p-tolylsulfonylamino)phenyl]sulfanyl-propanamid (2S)-N-(3-ethylsulfanyl-1,2,4-th…

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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) 4.57 7.92 -15.72 2 7 0 101 494.689 9 ↓
Mid Mid (pH 6-8) 4.57 7.98 -54.98 1 7 -1 103 493.681 9 ↓

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Rings

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

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