UCSF

ZINC02558404

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 14 No

Popular Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propylammonium 3-(3,5-dimethyl-4-nitro-pyrazol-…

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CAS Number: 1006962-55-5

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) -0.21 3.11 -55.33 3 6 1 91 199.234 4 ↓

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