UCSF

ZINC91365977

Substance Information

In ZINC since Heavy atoms Benign functionality
June 1st, 2013 0 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) 0.85 4.41 -24.7 3 3 0 55 191.259 0
Mid Mid (pH 6-8) 1.41 4.05 -36.64 2 3 -1 52 190.251 0

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

No pre-computed analogs available. Try a structural similarity search.