UCSF

ZINC59268633

Substance Information

In ZINC since Heavy atoms Benign functionality
March 1st, 2011 17 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) 0.08 8.14 -27.41 1 5 0 71 243.303 5
Hi High (pH 8-9.5) 0.08 5.98 -46.94 0 5 -1 70 242.295 5

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

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