UCSF

ZINC12081635

Substance Information

In ZINC since Heavy atoms Benign functionality
March 25th, 2008 36 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) 4.78 12.89 -52.8 2 7 1 72 486.592 9
Hi High (pH 8-9.5) 4.78 10.43 -15.33 1 7 0 71 485.584 9

Activity (Go SEA)

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