UCSF

ZINC02483952

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2004 31 No

Popular Name: (3aS,4S)-6-amino-4-(3-hydroxyphenyl)-3-(3,4,5-trimethoxyphenyl)-3a,4-dihydropyrano[2,3-c]pyrazole-5- (3aS,4S)-6-amino-4-(3-hydroxyphe…

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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) 2.02 0.77 -13.3 4 9 0 136 420.425 5 ↓
Mid Mid (pH 6-8) 2.02 1.45 -14.51 4 9 0 136 420.425 5 ↓
Lo Low (pH 4.5-6) 2.02 1.87 -62.64 5 9 1 137 421.433 5 ↓

Activity (Go SEA)

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