UCSF

ZINC49380531

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 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) 1.95 1.03 -12.15 3 6 0 87 295.726 5
Hi High (pH 8-9.5) 2.14 -1.62 -43.57 2 6 -1 94 294.718 5

Activity (Go SEA)

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