UCSF

ZINC35635609

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 31 Yes

Popular Name: (4R)-1-ethyl-4-(4-fluorophenyl)-6-[3-(4-methylpiperazin-1-yl)-3-oxo-propyl]-4,7-dihydro-3H-pyrrolo[3 (4R)-1-ethyl-4-(4-fluorophenyl)-…

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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) 1.82 6.68 -19.42 1 8 0 76 429.496 5 ↓
Mid Mid (pH 6-8) 1.82 9.02 -56.76 2 8 1 77 430.504 5 ↓

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

No pre-computed analogs available. Try a structural similarity search.