UCSF

ZINC34580854

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2009 21 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) -1.83 8.23 -122.64 0 9 -2 146 292.203 5
Lo Low (pH 4.5-6) -1.83 6.09 -54.15 1 9 -1 144 293.211 5

Activity (Go SEA)

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