UCSF

ZINC27316353

Substance Information

In ZINC since Heavy atoms Benign functionality
February 15th, 2009 23 No

Download: MOL2 SDF SMILES Flexibase

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) 2.10 9.95 -30.66 5 6 1 91 377.321 6
Hi High (pH 8-9.5) 2.23 9.99 -14.79 4 6 0 87 376.313 6

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

No pre-computed analogs available. Try a structural similarity search.