UCSF

ZINC58304911

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2011 22 No

Popular Name: 3-[2-[ethyl-[(3-nitrophenyl)methyl]amino]ethyl]-4-methyl-thiazol-2-one 3-[2-[ethyl-[(3-nitrophenyl)meth…

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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) 2.34 9.94 -54.34 1 6 1 72 322.41 7 ↓
Mid Mid (pH 6-8) 2.34 7.82 -16.28 0 6 0 71 321.402 7 ↓

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

No pre-computed analogs available. Try a structural similarity search.