UCSF

ZINC39322219

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 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) 1.63 5.89 -20.23 1 5 0 53 293.22 1
Hi High (pH 8-9.5) 1.26 4.68 -54.4 0 5 -1 59 292.212 2

Activity (Go SEA)

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