UCSF

ZINC41781528

Substance Information

In ZINC since Heavy atoms Benign functionality
April 22nd, 2010 20 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) 1.32 1.84 -19.17 3 6 0 87 295.726 4
Hi High (pH 8-9.5) 1.50 -0.82 -52.18 2 6 -1 94 294.718 4

Activity (Go SEA)

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