UCSF

ZINC11847632

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2008 20 Yes

Popular Name: 4-{[1-(3,4-dimethoxyphenyl)ethyl]amino}-4-oxobutanoic acid 4-{[1-(3,4-dimethoxyphenyl)ethyl…

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CAS Number: N/A

Other Names:

MFCD06056255

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) 0.81 -0.07 -50.54 1 6 -1 88 280.3 7 ↓

Activity (Go SEA)

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