UCSF

ZINC02570196

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 10 Yes

Popular Name: 2-n-Amylpropane-1,3-diol 2-n-Amylpropane-1,3-diol

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CAS Number: 25462-23-1

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) 1.87 -0.05 -4.41 2 2 0 40 146.23 6 ↓

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