UCSF

ZINC59418366

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 4th, 2011 36 No

Popular Name: N-[(E)-[5-(2-chloro-5-nitro-phenyl)-2-furyl]methyleneamino]-4-morpholino-6-(1-piperidyl)-1,3,5-triaz N-[(E)-[5-(2-chloro-5-nitro-phen…

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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) 5.51 18.08 -21.01 1 12 0 141 512.958 6 ↓
Lo Low (pH 4.5-6) 5.33 18.21 -35.6 2 12 1 139 513.966 7 ↓

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

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