UCSF

ZINC03679830

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 18 No

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Annotations

Vendors

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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) 2.56 6.78 -9.07 1 4 0 59 253.204 4
Hi High (pH 8-9.5) 2.56 6.36 -33.09 0 4 -1 57 252.196 4

Activity (Go SEA)

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