UCSF

ZINC19897772

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 31 No

Popular Name: (5R)-5-(3-chlorophenyl)-4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1-(2-dimethylaminoethyl)-3-hydro (5R)-5-(3-chlorophenyl)-4-(2,3-d…

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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) 2.57 9.67 -74.93 1 7 0 83 442.899 6 ↓
Hi High (pH 8-9.5) 2.57 7.14 -56.29 0 7 -1 82 441.891 6 ↓

Activity (Go SEA)

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