UCSF

ZINC01788640

Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2005 37 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) 6.58 16.69 -11.19 2 5 0 80 506.675 7
Mid Mid (pH 6-8) 6.58 16.71 -35.52 3 5 1 82 507.683 7

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

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