UCSF

ZINC66449314

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2011 26 No

Popular Name: 5-(dimethylamino)-3-[[phenethyl(4-pyridylmethyl)amino]methyl]-1,3,4-thiadiazole-2-thione 5-(dimethylamino)-3-[[phenethyl(…

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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) 2.54 9.68 -10.33 0 5 0 37 385.562 8 ↓
Lo Low (pH 4.5-6) 2.54 12.36 -41.26 1 5 1 38 386.57 8 ↓

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

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