UCSF

ZINC23739537

Substance Information

In ZINC since Heavy atoms Benign functionality
January 7th, 2009 21 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) 3.86 6.72 -10.58 1 5 0 80 309.749 7
Hi High (pH 8-9.5) 3.86 7.64 -44.66 0 5 -1 82 308.741 7

Activity (Go SEA)

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