UCSF

ZINC09436963

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 27th, 2007 32 No

Popular Name: 5-(2,4-dichlorophenyl)-4-[(4-ethoxyphenyl)-hydroxy-methylene]-1-[2-(2-hydroxyethoxy)ethyl]pyrrolidin 5-(2,4-dichlorophenyl)-4-[(4-eth…

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Download: MOL2 SDF SMILES Flexibase

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) 3.35 6.65 -60.13 1 7 -1 99 479.336 10 ↓
Mid Mid (pH 6-8) 3.80 5.97 -11.07 2 7 0 96 480.344 9 ↓
Mid Mid (pH 6-8) 2.77 7.16 -11.21 1 7 0 93 480.344 10 ↓
Mid Mid (pH 6-8) 2.49 5.43 -6.7 0 4 0 31 305.418 7 ↓

Activity (Go SEA)

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