UCSF

ZINC27048837

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2009 25 No

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) 1.99 7.58 -10.7 0 5 0 45 337.423 5
Mid Mid (pH 6-8) 1.99 9.91 -50.8 1 5 1 46 338.431 5

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