UCSF

ZINC59268661

Substance Information

In ZINC since Heavy atoms Benign functionality
March 1st, 2011 24 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) -1.93 5.05 -206.1 1 10 -3 187 333.232 5
Hi High (pH 8-9.5) -1.93 4.18 -294.99 0 10 -4 185 332.224 5
Mid Mid (pH 6-8) -1.93 5.9 -159.15 2 10 -2 188 334.24 5

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

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