UCSF

ZINC38603070

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 24 No

Popular Name: 2-thienyl-[4-[(2-thioxo-1,3-benzoxazol-3-yl)methyl]piperazin-1-yl]methanone 2-thienyl-[4-[(2-thioxo-1,3-benz…

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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) 2.43 6.86 -21.37 0 5 0 42 359.476 3 ↓
Lo Low (pH 4.5-6) 2.43 9.14 -60.37 1 5 1 43 360.484 3 ↓

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

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