UCSF

ZINC39270063

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 14 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) 2.06 2.43 -7.85 1 4 0 56 196.202 4
Hi High (pH 8-9.5) 2.06 3.44 -50.01 0 4 -1 59 195.194 4

Activity (Go SEA)

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