UCSF

ZINC04632427

Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2005 27 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) 1.51 -3.05 -54.92 4 6 1 94 367.425 7
Mid Mid (pH 6-8) 0.93 -3.16 -64.13 3 6 1 91 367.425 7

Activity (Go SEA)

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