UCSF

ZINC22684071

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 31 Yes

Popular Name: 1-(2-chlorophenyl)-N-[(2R)-2-dimethylamino-2-(4-ethylphenyl)ethyl]-6-methyl-4-oxo-pyridazine-3-carbo 1-(2-chlorophenyl)-N-[(2R)-2-dim…

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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) 4.24 13.14 -53.16 2 6 1 68 439.967 7 ↓
Hi High (pH 8-9.5) 4.24 10.79 -20.07 1 6 0 67 438.959 7 ↓

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

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