UCSF

ZINC37508733

Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2009 19 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 1.41 3.23 -46 3 5 1 64 281.357 3
Mid Mid (pH 6-8) 1.41 1.86 -10.49 2 5 0 60 280.349 3

Activity (Go SEA)

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