UCSF

ZINC41539228

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 23 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) 0.56 6.54 -41.05 2 7 1 87 313.337 4
Mid Mid (pH 6-8) 0.56 6.08 -18.13 1 7 0 86 312.329 4

Activity (Go SEA)

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