UCSF

ZINC66942036

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 3rd, 2011 25 No

Popular Name: [4-(5-chloro-2-pyridyl)piperazin-1-yl]-(3-hydroxy-4-nitro-phenyl)methanone [4-(5-chloro-2-pyridyl)piperazin…

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Vendors

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) 2.11 7.21 -14.03 1 8 0 102 362.773 3 ↓
Mid Mid (pH 6-8) 2.11 8.19 -48.68 0 8 -1 105 361.765 3 ↓

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

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