UCSF

ZINC14951128

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 33 No

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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) -0.36 -9.61 -32.87 8 12 0 211 464.379 4
Hi High (pH 8-9.5) -0.36 -8.6 -76.76 7 12 -1 213 463.371 4

Activity (Go SEA)

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