UCSF

ZINC02804912

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 35 No

Popular Name: methyl-[3-[(4-methyl-2-nitro-phenoxy)methyl]phenyl]BLAHcarboxylic-acid-methyl-ester methyl-[3-[(4-methyl-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) 5.46 15.94 -19.58 0 10 0 124 489.513 7 ↓

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

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