UCSF

ZINC36119212

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 32 Yes

Popular Name: N-benzyl-N-ethyl-4-[[(2-morpholino-3,4-dioxo-cyclobuten-1-yl)amino]methyl]cyclohexanecarboxamide N-benzyl-N-ethyl-4-[[(2-morpholi…

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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) -0.56 5.48 -22.07 1 7 0 88 439.556 6 ↓
Mid Mid (pH 6-8) -0.56 4.7 -36.68 2 7 1 85 440.564 6 ↓
Mid Mid (pH 6-8) -0.56 5.74 -37.28 2 7 1 85 440.564 6 ↓

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

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