UCSF

ZINC39767762

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 37 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) 5.56 13.45 -28.41 2 9 0 130 509.547 7
Hi High (pH 8-9.5) 5.63 11.07 -51.32 1 9 -1 136 508.539 7

Activity (Go SEA)

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