UCSF

ZINC05328940

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2006 21 Yes

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Annotations

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) 0.74 -8.76 -21.11 1 7 0 92 334.419 6
Hi High (pH 8-9.5) 0.74 -8.18 -49.77 0 7 -1 94 333.411 6

Activity (Go SEA)

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