UCSF

ZINC53474518

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2010 25 No

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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) 2.04 8.57 -50.51 2 6 1 57 363.507 5
Mid Mid (pH 6-8) 2.04 6.2 -16.24 1 6 0 56 362.499 5

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

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