UCSF

ZINC34827981

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 31 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) 4.97 13.21 -55.48 2 4 1 29 472.984 8
Hi High (pH 8-9.5) 4.97 10.83 -8.27 1 4 0 28 471.976 8

Activity (Go SEA)

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