UCSF

ZINC41537898

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 21 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) 1.26 5.52 -48.23 1 6 -1 88 294.327 7
Lo Low (pH 4.5-6) 1.26 3.54 -11.3 2 6 0 85 295.335 7

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Rings

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