UCSF

ZINC34678757

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2009 33 No

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Annotations

None

Vendors

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) 5.67 13.39 -11.63 0 6 0 69 467.928 6
Mid Mid (pH 6-8) 5.67 15.62 -58.48 1 6 1 71 468.936 6

Activity (Go SEA)

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