UCSF

ZINC59689592

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2011 26 No

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Annotations

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) 9.04 15.91 -49.74 1 3 -1 52 360.562 16
Lo Low (pH 4.5-6) 9.04 15.7 -35.8 2 3 0 57 361.57 16

Activity (Go SEA)

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