UCSF

ZINC65552935

Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2011 20 Yes

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) 2.63 3.8 -5.86 0 4 0 35 298.452 6
Lo Low (pH 4.5-6) 2.63 6.07 -39.5 1 4 1 36 299.46 6

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

No pre-computed analogs available. Try a structural similarity search.