UCSF

ZINC39917130

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 30 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) 4.35 12.4 -46.02 1 5 1 35 407.582 8
Mid Mid (pH 6-8) 4.35 10.05 -10.66 0 5 0 34 406.574 8
Mid Mid (pH 6-8) 4.35 13.18 -89.46 2 5 2 36 408.59 8
Mid Mid (pH 6-8) 4.35 12.29 -42.93 1 5 1 35 407.582 8

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