UCSF

ZINC34894323

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2009 24 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) 1.89 5.47 -78.03 1 10 -1 150 349.666 2
Lo Low (pH 4.5-6) 1.89 4.67 -101.39 2 10 0 147 350.674 2

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

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