UCSF

ZINC62838697

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 15th, 2011 19 Yes

Popular Name: (1S)-N'-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-1-phenyl-ethane-1,2-diamine (1S)-N'-(6,7-dihydro-5H-cyclopen…

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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) -0.02 6.51 -52.66 4 4 1 65 255.345 4 ↓
Hi High (pH 8-9.5) -0.02 6.15 -7.53 3 4 0 64 254.337 4 ↓
Mid Mid (pH 6-8) -0.02 6.94 -98.41 5 4 2 67 256.353 4 ↓

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

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