UCSF

ZINC21002781

Substance Information

In ZINC since Heavy atoms Benign functionality
November 30th, 2008 25 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) 4.28 9.95 -22.27 1 7 0 97 377.809 5
Hi High (pH 8-9.5) 4.47 8.87 -38.4 0 7 -1 103 376.801 5

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