UCSF

ZINC19973670

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 29 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) 2.88 9.19 -12.59 0 6 0 53 393.487 5
Ref Reference (pH 7) 2.88 8.97 -12.29 0 6 0 53 393.487 5
Mid Mid (pH 6-8) 2.88 11.37 -49.96 1 6 1 54 394.495 5

Activity (Go SEA)

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