UCSF

ZINC49349469

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2010 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) 0.00 5.37 -10.21 0 6 0 66 274.324 3
Lo Low (pH 4.5-6) 0.00 5.82 -41.87 1 6 1 67 275.332 3

Activity (Go SEA)

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