UCSF

ZINC23004989

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 23rd, 2008 28 Yes

Popular Name: 7-[[4-(4-chlorobenzoyl)piperazin-1-yl]methyl]-2-ethyl-[1,3,4]thiadiazolo[2,3-b]pyrimidin-5-one 7-[[4-(4-chlorobenzoyl)piperazin…

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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) 1.91 7.13 -18.5 0 7 0 71 417.922 4 ↓
Mid Mid (pH 6-8) 1.91 9.47 -58.87 1 7 1 72 418.93 4 ↓

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

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