UCSF

ZINC33935659

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2009 28 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) -0.93 4.58 -34.66 3 8 0 124 390.436 5
Hi High (pH 8-9.5) -0.93 3.54 -50.51 2 8 -1 119 389.428 5

Activity (Go SEA)

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