UCSF

ZINC38604334

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 16 No

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Annotations

None

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) 1.23 -0.95 -9.23 1 6 0 83 258.69 3
Lo Low (pH 4.5-6) 1.23 0.12 -47.58 2 6 1 85 259.698 3

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

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