UCSF

ZINC00400096

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 17 No

Popular Name: DibenzylcyanaMide DibenzylcyanaMide

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2451-91-4 , [221908-80-1]

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) 2.91 10.34 -8.75 0 2 0 27 222.291 4 ↓

Vendor Notes

Note Type Comments Provided By
BP 148 / 10 TCI
MP 54 TCI
melting_point 54 - 55 KeyOrganics

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