UCSF

ZINC00155916

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 12 Yes

Popular Name: H-D-Phg-OMe.HCl H-D-Phg-OMe.HCl

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CAS Number: 19883-41-1

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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 3.61 -43.25 3 3 1 54 172.248 3 ↓
Hi High (pH 8-9.5) 1.33 3.34 -4.63 2 3 0 52 171.24 3 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point ca 190? dec. Alfa-Aesar
Melting_Point ca 190° dec. Alfa-Aesar

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