UCSF

ZINC33590451

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 13th, 2009 32 No

Popular Name: 3-(3-chloro-4-methoxy-phenyl)-1-[(4-dimethylaminophenyl)methyl]-1-(3-morpholinopropyl)thiourea 3-(3-chloro-4-methoxy-phenyl)-1-…

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Download: MOL2 SDF SMILES Flexibase

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Vendors

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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) 3.90 10.43 -17.38 1 6 0 40 477.074 11 ↓
Mid Mid (pH 6-8) 3.90 12.72 -62.51 2 6 1 41 478.082 11 ↓
Lo Low (pH 4.5-6) 3.90 13.46 -84.95 3 6 0 43 479.09 11 ↓

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