UCSF

ZINC35623058

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 31 No

Popular Name: 3-(tert-butyl)-1-methyl-6-((((4-nitrophenyl)amino)thioxomethyl)amino)indeno[2,3-d]pyrazol-4-one 3-(tert-butyl)-1-methyl-6-((((4-…

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CAS Number: 1119392-40-3

Other Names:

MFCD06199189

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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) 4.13 11.82 -28.62 2 8 0 105 435.509 6 ↓

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

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