UCSF

ZINC23932307

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2009 29 No

Popular Name: (2E,4R)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxo-pentane (2E,4R)-2-(3H-1,3-benzothiazol-2…

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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) 3.86 13.95 -14.53 1 6 0 87 419.535 5 ↓

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

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