UCSF

ZINC20725287

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2008 26 Yes

Popular Name: (3S)-3-[[5-(4-hydroxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1,3,4,5-tetrahydro-1-benzazepin-2 (3S)-3-[[5-(4-hydroxyphenyl)-4-m…

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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) 3.31 7.65 -18.21 2 6 0 80 366.446 3 ↓

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