UCSF

ZINC40052182

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 34 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) 3.85 8.74 -60.03 1 9 -1 136 467.498 11
Lo Low (pH 4.5-6) 3.85 7.99 -21.25 2 9 0 133 468.506 11

Activity (Go SEA)

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