UCSF

ZINC55060729

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 25 No

Popular Name: N-(2,4-dimethoxyphenyl)-N'-[2-(1H-triazol-5-ylsulfanyl)ethyl]propanediamide N-(2,4-dimethoxyphenyl)-N'-[2-(1…

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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) 0.73 1.97 -20.66 3 9 0 118 365.415 9 ↓
Hi High (pH 8-9.5) 0.73 1.96 -50.29 2 9 -1 117 364.407 9 ↓

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

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