UCSF

ZINC69779818

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 21 Yes

Popular Name: (2R)-1-(2-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-3-morpholino-propan-2-ol (2R)-1-(2-methyl-6,8-dihydro-5H-…

Find On: PubMed — Wikipedia — Google

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) -0.60 1.49 -47.99 2 6 1 63 293.391 4 ↓
Hi High (pH 8-9.5) -0.60 -0.83 -9.55 1 6 0 62 292.383 4 ↓
Lo Low (pH 4.5-6) -0.60 3.81 -115.77 3 6 2 64 294.399 4 ↓
Lo Low (pH 4.5-6) -0.60 1.48 -42.92 2 6 1 63 293.391 4 ↓

Activity (Go SEA)

Rings

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

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