UCSF

ZINC63728884

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 4th, 2011 22 No

Popular Name: 3-[1-[[cyanomethyl(propyl)amino]methyl]-3-cyclopropyl-5-thioxo-1,2,4-triazol-4-yl]propanamide 3-[1-[[cyanomethyl(propyl)amino]…

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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) -0.35 5.18 -16.48 2 7 0 93 322.438 9 ↓

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

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