UCSF

ZINC22744740

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 29 Yes

Popular Name: (2S)-N-(3-ethylsulfanyl-1,2,4-thiadiazol-5-yl)-2-[4-(2-thienylsulfonylamino)phenyl]sulfanyl-propanam (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) 4.07 6.27 -54.59 1 7 -1 103 485.683 9 ↓
Lo Low (pH 4.5-6) 4.07 6.23 -15.91 2 7 0 101 486.691 9 ↓

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Rings

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

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