UCSF

ZINC01132263

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2004 35 No

Popular Name: (5R)-5-(3,4-dimethoxyphenyl)-1-(2-furfuryl)-2-keto-4-[(2R)-2-methylcoumaran-5-carbonyl]-3-pyrrolin-3 (5R)-5-(3,4-dimethoxyphenyl)-1-(…

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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) 3.07 9.05 -60.21 0 8 -1 101 474.489 7 ↓
Mid Mid (pH 6-8) 3.52 8.05 -29.79 1 8 0 98 475.497 6 ↓
Mid Mid (pH 6-8) 2.49 9.08 -22.68 0 8 0 95 475.497 7 ↓

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