UCSF

ZINC40189598

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 24 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 3.03 8.58 -12.98 1 6 0 73 331.416 8
Lo Low (pH 4.5-6) 3.03 8.82 -34.98 2 6 1 74 332.424 8

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