UCSF

ZINC55422061

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 14th, 2010 21 Yes

Popular Name: 7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-3-methyl-thiazolo[3,2-a]pyrimidin-5-one 7-[[4-(2-hydroxyethyl)piperazin-…

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Download: MOL2 SDF SMILES Flexibase

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) 0.31 1.02 -34.23 2 6 1 62 309.415 4 ↓
Hi High (pH 8-9.5) 0.31 0.62 -11.88 1 6 0 61 308.407 4 ↓
Mid Mid (pH 6-8) 0.31 3.35 -86.14 3 6 2 64 310.423 4 ↓

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

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