UCSF

ZINC39696863

Substance Information

In ZINC since Heavy atoms Benign functionality
March 3rd, 2010 35 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.82 5.67 -50.85 3 8 1 92 485.58 5
Mid Mid (pH 6-8) 1.82 8.09 -104.05 4 8 2 93 486.588 5

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