UCSF

ZINC39891633

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 16 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 0.92 1.93 -45.72 0 6 -1 77 263.368 5
Lo Low (pH 4.5-6) 0.92 2.03 -10.9 1 6 0 75 264.376 5

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