UCSF

ZINC58313279

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2011 24 Yes

Popular Name: 7-[(N-[(2R)-2-hydroxybutyl]anilino)methyl]-3-methyl-thiazolo[3,2-a]pyrimidin-5-one 7-[(N-[(2R)-2-hydroxybutyl]anili…

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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) 2.98 8.27 -39.34 2 5 1 59 344.46 6 ↓
Hi High (pH 8-9.5) 2.98 7.84 -11.7 1 5 0 58 343.452 6 ↓

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

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