UCSF

ZINC31818625

Substance Information

In ZINC since Heavy atoms Benign functionality
April 16th, 2009 28 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) 2.75 6.36 -22.59 5 10 0 166 417.476 6
Hi High (pH 8-9.5) 2.93 5.29 -52.81 4 10 -1 172 416.468 6

Activity (Go SEA)

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