In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2008 | 28 | Yes |
Popular Name: (2S)-1-[(1-benzylpyrrol-2-yl)methyl-(2-morpholinoethyl)amino]-3-methyl-butan-2-ol (2S)-1-[(1-benzylpyrrol-2-yl)met…
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) | 2.91 | 7.66 | -6.32 | 1 | 5 | 0 | 41 | 385.552 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.91 | 8.78 | -39.82 | 2 | 5 | 1 | 42 | 386.56 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.91 | 10.01 | -51.67 | 2 | 5 | 1 | 42 | 386.56 | 10 | ↓ |