Molecular moment similarity between clozapine and substituted [(4-phenylpiperazinyl)-methyl] benzamides: selective dopamine D4 agonists.

Authors

• B D Silverman
• M C Pitman
• D E Platt
• I Rigoutsos

Publication/Presentation Date

11-1-1998

Abstract

Moment descriptors of the molecular charge and mass distributions are investigated within the context of molecular similarity. Euclidean distances in the moment descriptor space are shown to yield molecular proximities in accord with chemical intuition for a substituted [(4-phenylpiperazinyl)-methyl] benzamide series of dopamine D4 agonists. The proximity of the dopamine D4 antagonist clozapine to the molecules of this series is also examined in the moment space.

Volume

12

Issue

6

First Page

525

Last Page

532

ISSN

0920-654X

Published In/Presented At

Silverman, B. D., Pitman, M. C., Platt, D. E., & Rigoutsos, I. (1998). Molecular moment similarity between clozapine and substituted [(4-phenylpiperazinyl)-methyl] benzamides: selective dopamine D4 agonists. Journal of computer-aided molecular design, 12(6), 525–532. https://doi.org/10.1023/a:1008064003409

Disciplines

Business Administration, Management, and Operations | Health and Medical Administration | Management Sciences and Quantitative Methods

PubMedID

9879500

Department(s)

Administration and Leadership

Document Type

Article