UCSF

ZINC16545731

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 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) 5.90 12.65 -14.57 0 4 0 38 417.512 3
Lo Low (pH 4.5-6) 5.90 15 -49.33 1 4 1 39 418.52 3

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