UCSF

ZINC39289088

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 17 Yes

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Annotations

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) 2.86 6.97 -48.36 1 5 -1 78 301.116 5
Lo Low (pH 4.5-6) 2.86 4.97 -8.47 2 5 0 76 302.124 5

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