UCSF

ZINC39916898

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 22 Yes

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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) 4.82 12.18 -34.72 1 3 1 22 300.47 7
Mid Mid (pH 6-8) 4.82 10.42 -22.47 1 3 1 22 300.47 7
Mid Mid (pH 6-8) 4.82 9.72 -8.44 0 3 0 21 299.462 7
Lo Low (pH 4.5-6) 4.82 12.85 -96.04 2 3 2 24 301.478 7

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