UCSF

ZINC26267970

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 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) 0.96 5.9 -26.43 3 8 0 109 349.416 7
Hi High (pH 8-9.5) 1.42 5.06 -58.86 2 8 -1 112 348.408 7

Activity (Go SEA)

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