UCSF

ZINC19927108

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 29 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) 2.24 6.51 -46.23 4 11 1 142 416.853 6
Hi High (pH 8-9.5) 2.24 3.98 -18.89 3 11 0 140 415.845 6

Activity (Go SEA)

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