UCSF

ZINC13127483

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 29th, 2008 25 Yes

Popular Name: (5S,7S)-5-(4-bromophenyl)-7-(4-methoxyphenyl)-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-a (5S,7S)-5-(4-bromophenyl)-7-(4-m…

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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) 3.60 9.93 -13.03 3 6 0 78 400.28 3 ↓
Lo Low (pH 4.5-6) 3.60 10.4 -40.39 4 6 1 79 401.288 3 ↓

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