UCSF

ZINC03766441

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2005 29 No

Popular Name: 5-benzo[1,3]dioxol-5-yl-1-(2-hydroxyethyl)-4-(1-hydroxy-3-phenyl-prop-2-enylidene)-pyrrolidine-2,3-d 5-benzo[1,3]dioxol-5-yl-1-(2-hyd…

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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) 2.01 5.79 -63.44 1 7 -1 99 392.387 6 ↓
Lo Low (pH 4.5-6) 2.01 4.9 -17.02 2 7 0 96 393.395 6 ↓

Activity (Go SEA)

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