UCSF

ZINC20218969

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 31 No

Popular Name: (5R)-5-(2,3-dimethoxyphenyl)-1-(2-dimethylaminoethyl)-4-[(E)-3-(2-furyl)prop-2-enoyl]-3-hydroxy-5H-p (5R)-5-(2,3-dimethoxyphenyl)-1-(…

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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) 1.68 8.89 -70.01 1 8 0 96 426.469 9 ↓
Hi High (pH 8-9.5) 1.68 6.79 -61.16 0 8 -1 95 425.461 9 ↓
Hi High (pH 8-9.5) 1.68 5.83 -46.36 0 8 -1 95 425.461 8 ↓

Activity (Go SEA)

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