UCSF

ZINC39755595

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 26 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) 4.18 11.58 -49.02 1 5 1 49 352.458 8
Hi High (pH 8-9.5) 4.18 9.43 -11.93 0 5 0 47 351.45 8
Lo Low (pH 4.5-6) 4.18 12.05 -88.65 2 5 2 50 353.466 8

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