UCSF

ZINC59953363

Substance Information

In ZINC since Heavy atoms Benign functionality
March 12th, 2011 28 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) 1.81 1.63 -44.25 1 8 -1 114 381.364 5
Mid Mid (pH 6-8) 1.35 4.08 -11.5 2 8 0 111 382.372 5

Activity (Go SEA)

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