UCSF

ZINC06624985

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 30 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) 3.25 10.35 -15.81 1 6 0 56 423.538 10
Lo Low (pH 4.5-6) 3.25 10.82 -51.7 2 6 1 57 424.546 10

Activity (Go SEA)

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