UCSF

ZINC71543235

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 31 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) -0.16 9.04 -123.48 1 10 -2 145 445.453 10
Lo Low (pH 4.5-6) -0.16 7.12 -71.22 2 10 -1 142 446.461 10

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

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