UCSF

ZINC22709062

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 32 No

Popular Name: (4S)-6-amino-4-[5-chloro-2-[(2-chloro-6-fluoro-phenyl)methoxy]phenyl]-3-propyl-1,4-dihydropyrano[5,6 (4S)-6-amino-4-[5-chloro-2-[(2-c…

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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) 5.52 8.02 -12.66 3 6 0 97 473.335 6 ↓
Lo Low (pH 4.5-6) 5.52 8.34 -52.57 4 6 1 99 474.343 6 ↓

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

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