UCSF

ZINC08996220

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2007 37 No

Popular Name: 1-(3-dimethylaminopropyl)-5-(4-fluorophenyl)-4-[hydroxy-[4-(m-tolylmethoxy)phenyl]-methylene]-pyrrol 1-(3-dimethylaminopropyl)-5-(4-f…

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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) 4.92 14.69 -78.36 1 6 0 74 502.586 10 ↓
Mid Mid (pH 6-8) 4.92 14.57 -46.48 2 6 1 71 503.594 10 ↓
Mid Mid (pH 6-8) 4.34 14.92 -48.77 1 6 1 68 503.594 10 ↓

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