UCSF

ZINC47463924

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2010 17 Yes

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Annotations

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) 1.50 1.97 -8.82 2 5 0 57 254.359 2
Mid Mid (pH 6-8) 1.50 4.7 -47.49 3 5 1 58 255.367 2

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