UCSF

ZINC42678431

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2010 19 Yes

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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) 1.81 5.29 -11.77 0 4 0 50 276.361 4
Lo Low (pH 4.5-6) 1.81 5.75 -38.8 1 4 1 52 277.369 4

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