UCSF

ZINC08915059

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2007 35 No

Popular Name: 5-(4-tert-butylphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-hydroxy-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one 5-(4-tert-butylphenyl)-1-(6-ethy…

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Other Names:

MFCD03692205

Download: MOL2 SDF SMILES Flexibase

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) 7.13 14.57 -58.33 0 5 -1 73 501.653 6 ↓
Mid Mid (pH 6-8) 7.57 13.75 -17.74 1 5 0 71 502.661 5 ↓

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