UCSF

ZINC06255966

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2006 27 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) 3.64 12.22 -18.24 1 4 0 37 377.513 8
Lo Low (pH 4.5-6) 3.64 12.68 -52.45 2 4 1 39 378.521 8

Activity (Go SEA)

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