UCSF

ZINC59563875

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2011 34 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) 5.01 9.56 -11.09 2 4 0 61 463.662 5
Lo Low (pH 4.5-6) 5.01 10.34 -72.53 3 4 0 62 464.67 5

Activity (Go SEA)

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