UCSF

ZINC14010912

Substance Information

In ZINC since Heavy atoms Benign functionality
July 1st, 2008 32 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) 2.28 6.78 -14.81 1 7 0 73 456.905 3
Ref Reference (pH 7) 2.28 6.74 -15.12 1 7 0 73 456.905 3
Mid Mid (pH 6-8) 2.28 9.2 -51.38 2 7 1 74 457.913 3

Activity (Go SEA)

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