UCSF

ZINC62038470

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2011 31 Yes

Popular Name: 2-[[(7R)-7-tert-butyl-4-oxo-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-2-yl]sulfanyl]-N-(2 2-[[(7R)-7-tert-butyl-4-oxo-5,6,…

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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) 6.16 7.3 -16.88 3 6 0 95 457.621 5 ↓
Hi High (pH 8-9.5) 6.62 5.93 -49.03 2 6 -1 98 456.613 5 ↓

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

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