UCSF

ZINC35017728

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 27 No

Popular Name: (2Z)-2-[[(4-fluorophenyl)methylamino]-hydroxy-methylene]-9,10,10-trimethyl-7,8-dihydro-6H-pyrimido[1 (2Z)-2-[[(4-fluorophenyl)methyla…

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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) 1.56 2.23 -11.11 2 7 0 91 374.416 3 ↓
Mid Mid (pH 6-8) 1.56 2.86 -53.43 1 7 -1 94 373.408 3 ↓
Mid Mid (pH 6-8) 1.56 4.61 -67.99 2 7 0 95 374.416 3 ↓
Lo Low (pH 4.5-6) 1.56 5.75 -97.89 4 7 2 94 376.432 3 ↓

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

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