UCSF

ZINC63752196

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 5th, 2011 28 No

Popular Name: (3R)-1-[(2S,7aR)-7-oxo-3,7a-dihydro-2H-thiazolo[4,5-d]pyrimidin-2-yl]-N-[(4-methoxyphenyl)methyl]pip (3R)-1-[(2S,7aR)-7-oxo-3,7a-dihy…

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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) 0.76 3.2 -19.77 2 8 0 95 401.492 5 ↓
Hi High (pH 8-9.5) 0.76 2.23 -41.85 1 8 -1 97 400.484 5 ↓
Mid Mid (pH 6-8) 0.76 3.64 -55.93 3 8 1 97 402.5 5 ↓
Mid Mid (pH 6-8) 0.76 3.42 -52.88 3 8 1 97 402.5 5 ↓

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

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