UCSF

ZINC69921413

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 22 No

Popular Name: N-[4-[[2-cyanoethyl(cyclopropyl)amino]methyl]-5-thioxo-1,3,4-thiadiazol-2-yl]-N-cyclopropyl-acetamid N-[4-[[2-cyanoethyl(cyclopropyl)…

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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) 0.18 8 -15.04 0 6 0 65 337.474 7 ↓
Lo Low (pH 4.5-6) 0.18 10.68 -51.37 1 6 1 66 338.482 7 ↓

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

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