UCSF

ZINC02073852

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 34 No

Popular Name: 3-{3-(2,6-dimethylphenyl)-2-[(2,6-dimethylphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}-5-methyl-1,3-dihydro-2H-indol-2-one 3-{3-(2,6-dimethylphenyl)-2-[(2,…

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Other Names:

MFCD02071076

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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) 8.18 15.07 -11.67 1 5 0 67 467.594 2 ↓
Ref Reference (pH 7) 8.18 12.78 -11.27 1 5 0 67 467.594 2 ↓
Mid Mid (pH 6-8) 8.51 10.8 -51.82 0 5 -1 70 466.586 2 ↓
Mid Mid (pH 6-8) 8.51 13.1 -51.29 0 5 -1 70 466.586 2 ↓
Lo Low (pH 4.5-6) 8.18 15.19 -22.47 2 5 1 69 468.602 2 ↓

Activity (Go SEA)

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