UCSF

ZINC62611562

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2011 15 Yes

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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) 1.73 4.36 -48.53 2 3 1 37 225.337 1
Mid Mid (pH 6-8) 1.73 3.19 -8.38 1 3 0 32 224.329 1

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

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