UCSF

ZINC33725301

Substance Information

In ZINC since Heavy atoms Benign functionality
July 16th, 2009 32 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) 4.00 10.49 -14 1 6 0 46 457.64 12
Mid Mid (pH 6-8) 4.00 12.75 -56.72 2 6 1 47 458.648 12

Activity (Go SEA)

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