UCSF

ZINC31915047

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 21 No

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Annotations

Vendors

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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) 4.58 9.84 -12.13 0 3 0 27 300.789 3
Mid Mid (pH 6-8) 4.58 10.26 -29.55 1 3 1 28 301.797 3

Activity (Go SEA)

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