UCSF

ZINC41588648

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 29 No

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Annotations

None

Vendors

    None

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) 2.93 8.06 -14.27 0 6 0 69 388.423 3
Mid Mid (pH 6-8) 2.93 8.8 -44.28 1 6 1 70 389.431 3

Activity (Go SEA)

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