UCSF

ZINC02092718

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 34 Yes

Popular Name: (2S)-2-(tosylamino)propionic-acid-(6-keto-8-methoxy-4-methyl-benzo[c]isochromen-3-yl)-ester (2S)-2-(tosylamino)propionic-aci…

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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) 4.33 -0.7 -20.71 1 8 0 111 481.526 7 ↓

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Rings

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

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