UCSF

ZINC19883174

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 28 No

Popular Name: (5R)-1-(2-dimethylaminoethyl)-4-(furan-2-carbonyl)-3-hydroxy-5-(4-nitrophenyl)-5H-pyrrol-2-one (5R)-1-(2-dimethylaminoethyl)-4-…

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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) 1.62 8.73 -75.57 1 9 0 124 385.376 7 ↓
Hi High (pH 8-9.5) 1.62 6.2 -55.11 0 9 -1 123 384.368 7 ↓
Lo Low (pH 4.5-6) 1.62 7.91 -59.56 2 9 1 121 386.384 7 ↓

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