UCSF

ZINC36160617

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 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) 1.50 3.23 -60.27 3 4 1 65 297.444 4
Lo Low (pH 4.5-6) 1.50 4.17 -145.71 4 4 2 66 298.452 4

Activity (Go SEA)

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