UCSF

ZINC39315570

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 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) 1.73 6.74 -14.01 0 3 0 39 281.384 1
Lo Low (pH 4.5-6) 1.73 9.16 -63.03 1 3 1 41 282.392 1

Activity (Go SEA)

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