UCSF

ZINC34394481

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2009 34 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) 4.24 14 -33.25 3 7 1 88 464.565 8
Hi High (pH 8-9.5) 4.24 13.66 -13.07 2 7 0 87 463.557 8

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