UCSF

ZINC38741338

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2010 31 Yes

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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) 4.49 11.26 -46.55 1 8 -1 120 415.477 4
Mid Mid (pH 6-8) 4.03 12.66 -14.78 2 8 0 116 416.485 4

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

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