UCSF

ZINC00747224

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 35 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) 2.90 6.77 -28.74 2 10 0 120 501.971 8
Mid Mid (pH 6-8) 2.90 9.11 -70.69 3 10 1 121 502.979 8

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

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