UCSF

ZINC95921954

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2014 13 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) 2.33 6.64 -9.41 0 2 0 18 172.231 1
Mid Mid (pH 6-8) 2.33 7.08 -23.09 1 2 1 19 173.239 1

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

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