UCSF

ZINC65533735

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 26 Yes

Popular Name: N-(6-tert-butylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)-N'-(2-quinolyl)ethane-1,2-diamine N-(6-tert-butylimidazo[2,1-b][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) 4.45 9.23 -15.81 2 6 0 67 366.494 6 ↓
Mid Mid (pH 6-8) 4.45 9.68 -41.5 3 6 1 68 367.502 6 ↓
Lo Low (pH 4.5-6) 4.45 10.01 -71.06 4 6 2 70 368.51 6 ↓

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

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