UCSF

ZINC39916987

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 27 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) 4.59 13.23 -38.56 1 4 1 31 364.513 8
Mid Mid (pH 6-8) 4.59 10.76 -10.78 0 4 0 30 363.505 8
Mid Mid (pH 6-8) 4.59 11.48 -26.58 1 4 1 32 364.513 8

Activity (Go SEA)

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