UCSF

ZINC32123621

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 20 No

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) 0.86 2.54 -11.84 1 5 0 53 278.352 5
Lo Low (pH 4.5-6) 0.86 4.83 -54.08 2 5 1 54 279.36 5

Activity (Go SEA)

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