UCSF

ZINC25763956

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2009 30 No

Popular Name: 3-(4-amino-1,2,5-oxadiazol-3-yl)-5-(diethylaminomethyl)-N-(3-phenylpropylideneamino)triazole-4-carbo 3-(4-amino-1,2,5-oxadiazol-3-yl)…

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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) 2.13 7.66 -43.83 4 11 1 142 412.478 10 ↓
Hi High (pH 8-9.5) 2.13 5.34 -16.57 3 11 0 140 411.47 10 ↓

Activity (Go SEA)

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