UCSF

ZINC34234820

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2009 25 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) 2.94 2.59 -48.13 1 6 -1 95 404.171 2
Hi High (pH 8-9.5) 2.94 3.36 -104.82 0 6 -2 98 403.163 2
Lo Low (pH 4.5-6) 2.48 5.01 -12.62 2 6 0 92 405.179 2

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