UCSF

ZINC04792436

Substance Information

In ZINC since Heavy atoms Benign functionality
January 4th, 2006 20 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) 2.71 3.21 -5.53 2 5 0 75 274.32 3
Hi High (pH 8-9.5) 2.56 0.83 -37.78 1 5 -1 82 273.312 3
Hi High (pH 8-9.5) 2.00 0.68 -38.26 1 5 -1 82 273.312 3

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