UCSF

ZINC63099628

Substance Information

In ZINC since Heavy atoms Benign functionality
May 24th, 2011 17 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) 3.18 6.62 -4.47 1 1 0 12 261.312 4
Mid Mid (pH 6-8) 3.18 7.84 -47.09 2 1 1 17 262.32 4

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

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