UCSF

ZINC45823759

Substance Information

In ZINC since Heavy atoms Benign functionality
August 4th, 2010 17 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) -4.76 2.62 -80.48 4 7 -1 137 245.255 7

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