UCSF

ZINC30826487

Substance Information

In ZINC since Heavy atoms Benign functionality
April 3rd, 2009 31 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) 5.21 8.73 -31.12 2 8 0 117 435.461 5
Hi High (pH 8-9.5) 5.21 9.34 -67.17 1 8 -1 120 434.453 5

Activity (Go SEA)

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