UCSF

ZINC22066124

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 10 No

Popular Name: 2-ene-Valproic acid 2-ene-Valproic acid

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CAS Number: 60218-41-9

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) 2.33 5.31 -50.71 0 2 -1 40 141.19 4 ↓
Lo Low (pH 4.5-6) 2.33 4.21 -6.77 1 2 0 37 142.198 4 ↓

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