UCSF

ZINC06678630

Substance Information

In ZINC since Heavy atoms Benign functionality
April 14th, 2006 18 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) 1.97 5.02 -7.59 2 4 0 58 279.39 1
Hi High (pH 8-9.5) 2.15 4.04 -48.05 1 4 -1 59 278.382 1

Activity (Go SEA)

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