UCSF

ZINC20238475

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 35 No

Popular Name: (5Z)-5-[[5-(4-ethoxy-2-nitro-phenyl)-2-furyl]methylene]-1-[(1R)-1-phenylethyl]hexahydropyrimidine-2, (5Z)-5-[[5-(4-ethoxy-2-nitro-phe…

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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) 4.27 10.61 -58.28 0 10 -1 143 474.449 7 ↓
Lo Low (pH 4.5-6) 3.81 12.39 -19.15 1 10 0 140 475.457 7 ↓

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

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