UCSF

ZINC36154664

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 26 Yes

Popular Name: 3-[5-[[3-methoxypropyl(2-thienylmethyl)amino]methyl]-2-furyl]-2,4-dimethyl-penta-1,4-dien-3-ol 3-[5-[[3-methoxypropyl(2-thienyl…

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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) 4.57 9.43 -39.22 2 4 1 47 376.542 11 ↓
Hi High (pH 8-9.5) 4.57 7.32 -5.79 1 4 0 46 375.534 11 ↓

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

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