UCSF

ZINC22743189

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 33 Yes

Popular Name: 2-[[4-amino-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-[4-(2-phenoxyethyl)piperazin-1-yl]eth 2-[[4-amino-5-(4-methoxyphenyl)-…

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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) 2.86 8.52 -15.76 2 9 0 99 468.583 9 ↓
Mid Mid (pH 6-8) 2.86 10.85 -52.43 3 9 1 100 469.591 9 ↓

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Rings

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