UCSF

ZINC49227490

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 25th, 2010 19 No

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

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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) -0.31 7.28 -44.57 3 6 1 70 284.409 7 ↓
Hi High (pH 8-9.5) -0.31 4.79 -14.64 2 6 0 69 283.401 7 ↓

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

No pre-computed analogs available. Try a structural similarity search.