UCSF

ZINC62316931

Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2011 27 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) 4.06 10.92 -10.58 0 4 0 42 386.923 7
Lo Low (pH 4.5-6) 4.06 11.05 -40.06 1 4 1 44 387.931 7

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

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