UCSF

ZINC39757579

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 35 Yes

Popular Name: (2R)-2-[[4-allyl-5-[(1S)-1-[[2-(4-methoxyphenyl)acetyl]amino]ethyl]-1,2,4-triazol-3-yl]sulfanyl]-N-( (2R)-2-[[4-allyl-5-[(1S)-1-[[2-(…

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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) 2.53 9.6 -25.47 2 10 0 124 515.665 12 ↓
Hi High (pH 8-9.5) 2.71 8.06 -58.37 1 10 -1 130 514.657 12 ↓

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