UCSF

ZINC39762698

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 32 Yes

Popular Name: 2-[[5-(3-isopropoxyphenyl)-4-(3-methoxypropyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-pyridylmethyl)aceta 2-[[5-(3-isopropoxyphenyl)-4-(3-…

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Vendors

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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) 2.79 9.23 -15.22 1 8 0 91 455.584 12 ↓
Lo Low (pH 4.5-6) 2.79 9.65 -46.64 2 8 1 92 456.592 12 ↓

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