UCSF

ZINC05016731

Substance Information

In ZINC since Heavy atoms Benign functionality
January 16th, 2006 28 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) 1.87 8.34 -45.19 2 6 1 75 380.468 8
Mid Mid (pH 6-8) 1.29 9.02 -54.3 1 6 1 72 380.468 8

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