UCSF

ZINC20229092

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 25 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) 5.34 7.32 -9.32 1 5 0 64 374.849 4
Ref Reference (pH 7) 4.85 6.71 -44.49 0 5 -1 63 373.841 5

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