UCSF

ZINC22011078

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 32 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) 3.36 7.76 -84.4 4 5 2 59 448.692 2
Mid Mid (pH 6-8) 3.36 7.66 -42.39 3 5 1 57 447.684 2

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