UCSF

ZINC64220152

Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2011 17 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) 2.73 4.01 -9.29 1 2 0 29 267.144 5
Hi High (pH 8-9.5) 2.92 1.81 -41.21 0 2 -1 35 266.136 5

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

No pre-computed analogs available. Try a structural similarity search.