UCSF

ZINC04243779

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 17 Yes

Popular Name: 5-(3,4-Dichloro-phenyl)-1 H -pyrazole-3-carboxylic acid methyl ester 5-(3,4-Dichloro-phenyl)-1 H -pyr…

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CAS Number: 192702-24-2

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) 3.35 6.16 -6.74 1 4 0 55 271.103 3 ↓
Ref Reference (pH 7) 3.35 6.13 -7.91 1 4 0 55 271.103 3 ↓

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

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