UCSF

ZINC65739198

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2011 24 No

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Annotations

None

Vendors

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) -0.47 1.1 -51.37 4 8 1 103 368.882 17
Hi High (pH 8-9.5) -0.47 -0.34 -18.4 3 8 0 98 367.874 17

Activity (Go SEA)

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