UCSF

ZINC16473981

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 29th, 2008 28 Yes

Popular Name: 6-acetyl-2-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-5-methyl-3H-thieno[4,5-e]pyrimidin-4-one 6-acetyl-2-[[4-(2-fluorophenyl)p…

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Annotations

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Vendors

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) 2.87 8.14 -14.46 1 6 0 69 400.479 4 ↓
Mid Mid (pH 6-8) 2.87 10.3 -58 2 6 1 70 401.487 4 ↓

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