UCSF

ZINC38574041

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 31 No

Popular Name: (4S,7aR)-6-amino-4-(4-benzyloxy-3-methoxy-phenyl)-3-(methoxymethyl)-4,7a-dihydropyrano[2,3-c]pyrazol (4S,7aR)-6-amino-4-(4-benzyloxy-…

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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) 3.09 2.16 -13.35 2 8 0 111 418.453 7 ↓
Lo Low (pH 4.5-6) 3.09 2.52 -56.94 3 8 1 113 419.461 7 ↓

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

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