UCSF

ZINC64219459

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2011 16 Yes

Popular Name: L-TRYPTOPHAN METHYLESTER HYDROCHLORIDE; [7524-52-9] L-TRYPTOPHAN METHYLESTER HYDROCH…

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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) 0.57 2.69 -7.24 3 4 0 64 220.272 4 ↓
Mid Mid (pH 6-8) 0.57 3 -48.93 4 4 1 66 221.28 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 214-215o C Indofine
MP 218-220 °C(lit.) Indofine

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.