UCSF

ZINC39756256

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 35 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) 3.53 6.92 -27.69 2 13 0 189 474.389 7
Hi High (pH 8-9.5) 3.60 4.32 -68.16 1 13 -1 195 473.381 7

Activity (Go SEA)

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