UCSF

ZINC69516411

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2011 26 Yes

Popular Name: (2R)-3-phenyl-1-pyrrolidin-1-yl-2-[[(6R)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl]methylamino (2R)-3-phenyl-1-pyrrolidin-1-yl-…

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Download: MOL2 SDF SMILES Flexibase

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) 1.93 7.99 -48.97 3 6 1 67 354.478 6 ↓
Mid Mid (pH 6-8) 1.93 6.88 -13.83 2 6 0 62 353.47 6 ↓
Mid Mid (pH 6-8) 1.93 7.04 -34.23 3 6 1 63 354.478 6 ↓
Lo Low (pH 4.5-6) 1.93 8.15 -91.83 4 6 2 68 355.486 6 ↓

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

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