UCSF

ZINC37083488

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 14 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) 2.26 5.79 -34.05 2 2 1 16 215.386 3
Hi High (pH 8-9.5) 2.26 3.46 -2.23 1 2 0 15 214.378 3

Activity (Go SEA)

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