UCSF

ZINC13549415

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 19 No

Popular Name: 3,4-dimethoxybenzaldehyde (4-oxo-1,3-thiazolidin-2-ylidene)hydrazone 3,4-dimethoxybenzaldehyde (4-oxo…

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Other Names:

MFCD00658564

MFCD02666615

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) 0.80 4.31 -11.64 1 6 0 72 279.321 4 ↓
Ref Reference (pH 7) 0.80 4.28 -10.94 1 6 0 72 279.321 4 ↓
Ref Reference (pH 7) 1.33 3.33 -18.24 1 6 0 72 279.321 5 ↓

Activity (Go SEA)

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