UCSF

ZINC21739789

Substance Information

In ZINC since Heavy atoms Benign functionality
December 8th, 2008 32 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) 0.72 4.62 -26.25 3 11 0 143 446.46 8
Hi High (pH 8-9.5) 0.90 3.84 -58.44 2 11 -1 149 445.452 8

Activity (Go SEA)

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