UCSF

ZINC08818085

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 29th, 2007 36 No

Popular Name: 4-[hydroxy-(4-methoxy-2-methyl-phenyl)-methylene]-1-(3-morpholinopropyl)-5-(4-nitrophenyl)-pyrrolidi 4-[hydroxy-(4-methoxy-2-methyl-p…

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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) 2.92 9.01 -55.36 0 10 -1 128 494.524 9 ↓
Mid Mid (pH 6-8) 2.33 10.37 -56.14 1 10 1 123 496.54 9 ↓
Mid Mid (pH 6-8) 2.92 11.34 -78 1 10 0 129 495.532 9 ↓

Activity (Go SEA)

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