UCSF

ZINC40192407

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 31 Yes

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Annotations

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) 2.93 11.11 -22.02 1 7 0 76 420.513 7
Mid Mid (pH 6-8) 2.93 11.56 -37.16 2 7 1 78 421.521 7

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