UCSF

ZINC66968461

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 3rd, 2011 24 Yes

Popular Name: 1-[3-chloro-2-(2-methoxyethoxy)phenyl]-3-[2-(2-pyridyl)ethyl]urea 1-[3-chloro-2-(2-methoxyethoxy)p…

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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) 2.61 5.17 -12.92 2 6 0 72 349.818 8 ↓
Lo Low (pH 4.5-6) 2.61 5.51 -41.45 3 6 1 74 350.826 8 ↓

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

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