UCSF

ZINC39272576

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 26 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) -0.01 1.19 -38.55 0 10 -1 113 380.816 6
Mid Mid (pH 6-8) -0.01 1.68 -13.72 1 10 0 111 381.824 5

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

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