UCSF

ZINC02034754

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2004 21 Yes

Popular Name: Chlorphenoxamine Chlorphenoxamine

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CAS Numbers: 562-09-4 , 77-38-3 , [77-38-3]

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) 4.00 2.69 -37.3 1 2 1 13 304.841 6 ↓
Hi High (pH 8-9.5) 2.12 6.17 -15.69 5 8 0 133 433.422 4 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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