UCSF

ZINC12383165

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 12th, 2008 14 Yes

Popular Name: 3-(1-aminoethyl)adamantan-1-ol 3-(1-aminoethyl)adamantan-1-ol

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CAS Number: 90812-24-1

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) 1.33 1.67 -42.7 4 2 1 48 196.314 1 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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