UCSF

ZINC25510890

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2009 32 Yes

Popular Name: 2-[[4-amino-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-1-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazi 2-[[4-amino-5-(p-tolyl)-1,2,4-tr…

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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) 3.71 10.23 -14.27 2 7 0 80 474.993 6 ↓
Mid Mid (pH 6-8) 3.71 12.56 -45.04 3 7 1 81 476.001 6 ↓

Activity (Go SEA)

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