UCSF

ZINC24025207

Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 2009 30 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) 3.19 7.63 -19.38 2 8 0 108 426.498 5
Hi High (pH 8-9.5) 3.01 6.55 -48.49 1 8 -1 115 425.49 5

Activity (Go SEA)

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