UCSF

ZINC55575803

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 16th, 2010 26 No

Popular Name: 2-phenyl-4-[4-[(3R)-tetrahydrothiophen-3-yl]piperazin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine 2-phenyl-4-[4-[(3R)-tetrahydroth…

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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) 3.77 10.99 -27.95 1 4 1 34 367.542 3 ↓
Mid Mid (pH 6-8) 3.77 13.36 -86.09 2 4 2 35 368.55 3 ↓
Mid Mid (pH 6-8) 3.77 10.67 -9.31 0 4 0 32 366.534 3 ↓

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

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