UCSF

ZINC25782992

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2009 36 No

Popular Name: 3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[[4-(2-amino-2-oxo-ethoxy)-3-ethoxy-phenyl]methyleneamino]-5-(pyr 3-(4-amino-1,2,5-oxadiazol-3-yl)…

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Download: MOL2 SDF SMILES Flexibase

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) 0.34 4.09 -59.87 6 15 1 203 499.512 11 ↓
Hi High (pH 8-9.5) 0.34 1.55 -29.41 5 15 0 202 498.504 11 ↓

Activity (Go SEA)

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