UCSF

ZINC32086696

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2009 24 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) 3.66 7.21 -49.44 3 3 1 34 324.492 5
Mid Mid (pH 6-8) 3.66 9.26 -132.49 4 3 2 35 325.5 5

Activity (Go SEA)

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