UCSF

ZINC06571007

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2006 26 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) 1.95 9.78 -16.77 1 5 0 50 364.474 8
Lo Low (pH 4.5-6) 1.95 10.24 -51.68 2 5 1 52 365.482 8

Activity (Go SEA)

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