UCSF

ZINC38139292

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 4th, 2010 40 No

Popular Name: (3R)-N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-1-(7,8,9,10-tetrahydro-6H-purino[9,8-a]azepin-4 (3R)-N-[3-[4-(2-methoxyphenyl)pi…

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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) 3.89 15.07 -51.71 2 10 1 93 547.728 8 ↓
Mid Mid (pH 6-8) 3.89 12.85 -16.95 1 10 0 92 546.72 8 ↓

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