UCSF

ZINC34380984

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2009 13 No

Popular Name: (S)-2-Chloro-1-(3,4-methylenedioxyphenyl)ethanol (S)-2-Chloro-1-(3,4-methylenedio…

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CAS Number: 313216-50-1

Other Names:

MFCD11110276

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) 1.62 2.05 -7.58 1 3 0 39 200.621 2 ↓

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