UCSF

ZINC39750894

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2010 29 Yes

Popular Name: (2S)-2-[[4-allyl-5-(morpholinomethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethyl-5-methyl-thiazol-2-yl) (2S)-2-[[4-allyl-5-(morpholinome…

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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) 2.01 7.44 -13.17 1 8 0 85 436.607 9 ↓
Lo Low (pH 4.5-6) 2.01 9.68 -49.19 2 8 1 86 437.615 9 ↓

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