UCSF

ZINC62038796

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2011 31 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) 5.08 8.85 -13.11 2 6 0 92 469.975 6
Hi High (pH 8-9.5) 5.08 9.63 -42.54 1 6 -1 95 468.967 6

Activity (Go SEA)

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