UCSF

ZINC09422067

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2007 34 No

Popular Name: 3-pyridylmethyl-[(2,4,5-trimethoxyphenyl)methylene]BLAHone 3-pyridylmethyl-[(2,4,5-trimetho…

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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) 2.64 6.34 -14.66 0 8 0 83 460.486 6 ↓
Lo Low (pH 4.5-6) 2.64 1.63 -128.71 2 8 2 85 462.502 6 ↓

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Rings

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