UCSF

ZINC22748005

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 34 No

Popular Name: (4S)-6-amino-4-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-3-propyl-1,4-dihydropyrano (4S)-6-amino-4-[3-(1,3-benzothia…

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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) 5.25 7.6 -15.53 3 7 0 110 489.626 7 ↓
Lo Low (pH 4.5-6) 5.25 7.92 -60.86 4 7 1 111 490.634 7 ↓

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

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