UCSF

ZINC33773872

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2009 37 No

Popular Name: (4Z,5R)-4-[hydroxy(4-pyridyl)methylene]-5-(4-isopentyloxy-3-methoxy-phenyl)-1-(2-morpholinoethyl)pyr (4Z,5R)-4-[hydroxy(4-pyridyl)met…

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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) 2.26 8.23 -52.5 0 9 -1 104 508.595 11 ↓
Mid Mid (pH 6-8) 2.26 10.58 -71.05 1 9 0 105 509.603 11 ↓
Lo Low (pH 4.5-6) 2.26 9.28 -64.29 2 9 1 103 510.611 11 ↓

Activity (Go SEA)

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