UCSF

ZINC04381418

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2005 25 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) 4.77 11.94 -19.49 1 6 0 75 336.395 4
Lo Low (pH 4.5-6) 4.77 11.53 -30.34 2 6 1 76 337.403 4

Activity (Go SEA)

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