UCSF

ZINC66066452

Substance Information

In ZINC since Heavy atoms Benign functionality
August 18th, 2011 25 No

Download: MOL2 SDF SMILES Flexibase

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) 2.41 5.09 -14.22 3 6 0 94 373.356 5
Mid Mid (pH 6-8) 2.41 5.82 -42.25 2 6 -1 97 372.348 5

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

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