UCSF

ZINC02792338

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 35 No

Popular Name: (4S)-6-amino-4-[3-[(3,5-dimethylpyrazol-1-yl)methyl]-4-methoxy-phenyl]-3-methyl-1-phenyl-4H-pyrano[2 (4S)-6-amino-4-[3-[(3,5-dimethyl…

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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) 3.26 9.49 -16.91 2 8 0 104 466.545 5 ↓
Lo Low (pH 4.5-6) 3.26 9.81 -60.43 3 8 1 106 467.553 5 ↓

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