UCSF

ZINC08996986

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2007 32 No

Popular Name: 1-(3-dimethylaminopropyl)-4-[hydroxy-(4-methoxy-3-methyl-phenyl)-methylene]-5-(2-methoxyphenyl)-pyrr 1-(3-dimethylaminopropyl)-4-[hyd…

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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) 3.12 9.41 -79.21 1 7 0 83 438.524 9 ↓
Mid Mid (pH 6-8) 2.54 11.89 -44.51 1 7 1 77 439.532 9 ↓
Mid Mid (pH 6-8) 3.57 10.5 -48.43 2 7 1 81 439.532 8 ↓

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