UCSF

ZINC65528502

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 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) 1.18 2.08 -11.67 3 7 0 76 330.436 4
Lo Low (pH 4.5-6) 1.18 4.4 -47.35 4 7 1 77 331.444 4

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

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