UCSF

ZINC05764081

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2006 21 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) 4.36 8.14 -38.7 2 2 1 25 327.275 2
Hi High (pH 8-9.5) 4.36 6.28 -3.5 1 2 0 23 326.267 2

Activity (Go SEA)

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