UCSF

ZINC31915112

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 20 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) 4.43 10.73 -11.61 0 2 0 17 284.79 2
Mid Mid (pH 6-8) 4.43 11.15 -26.41 1 2 1 19 285.798 2

Activity (Go SEA)

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