UCSF

ZINC32144711

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 21 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) 2.16 3.39 -4.89 2 4 0 42 289.423 4
Mid Mid (pH 6-8) 2.16 5.72 -36.19 3 4 1 43 290.431 4

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