UCSF

ZINC01266129

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2004 25 No

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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) 5.49 7.34 -8.73 1 5 0 64 419.3 4
Ref Reference (pH 7) 5.49 7.76 -8.86 1 5 0 64 419.3 4
Mid Mid (pH 6-8) 5.00 7.72 -18.93 1 5 0 60 419.3 5

Activity (Go SEA)

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