UCSF

ZINC53641620

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 26 Yes

Popular Name: (3S)-3-[4-[6-(4-fluorophenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperazin-1-yl]butanenitrile (3S)-3-[4-[6-(4-fluorophenyl)imi…

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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) 2.44 9.37 -15.82 0 6 0 60 370.457 4 ↓
Lo Low (pH 4.5-6) 2.44 11.3 -59.62 1 6 1 62 371.465 4 ↓

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

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