UCSF

ZINC33737251

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 31 No

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Annotations

Vendors

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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) 2.68 11.28 -15.05 1 5 0 62 435.524 5
Lo Low (pH 4.5-6) 2.68 11.71 -49.35 2 5 1 64 436.532 5

Activity (Go SEA)

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