UCSF

ZINC11840442

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2008 29 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) 2.58 -1.39 -16.01 1 5 0 62 409.555 5
Lo Low (pH 4.5-6) 2.58 -1.33 -50.75 2 5 1 64 410.563 5

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

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