UCSF

ZINC68923568

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 15th, 2011 22 Yes

Popular Name: 7-[[2-chloro-5-(hydroxymethyl)anilino]methyl]-3-methyl-thiazolo[3,2-a]pyrimidin-5-one 7-[[2-chloro-5-(hydroxymethyl)an…

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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) 2.45 5.05 -36.92 3 5 1 68 336.824 4 ↓
Hi High (pH 8-9.5) 2.45 4.66 -12.37 2 5 0 67 335.816 4 ↓

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

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