UCSF

ZINC19928271

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 33 No

Popular Name: 4-[(2S)-2-(4-chlorophenyl)-1-(2-dimethylaminoethyl)-4-hydroxy-5-oxo-2H-pyrrole-3-carbonyl]-N,N-dimet 4-[(2S)-2-(4-chlorophenyl)-1-(2-…

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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) 2.40 7.91 -70.77 1 8 0 102 491.997 8 ↓
Hi High (pH 8-9.5) 2.40 5.37 -56.15 0 8 -1 101 490.989 8 ↓

Activity (Go SEA)

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