UCSF

ZINC39849121

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 33 No

Popular Name: (2R)-1-[3-(diethylamino)propyl]-4-hydroxy-2-(2-methoxyphenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol (2R)-1-[3-(diethylamino)propyl]-…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 3.81 14.14 -59.08 1 6 0 74 448.563 11 ↓
Lo Low (pH 4.5-6) 3.81 13.42 -39.81 2 6 1 71 449.571 11 ↓

Activity (Go SEA)

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