UCSF

ZINC60210463

Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2011 35 No

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Annotations

Vendors

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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) 5.34 14.1 -19.69 0 8 0 111 476.529 8
Mid Mid (pH 6-8) 5.52 13 -12.58 0 8 0 111 476.529 8

Activity (Go SEA)

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