In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2009 | 17 | Yes |
Popular Name: 4-[isopropyl-[(1-methylimidazol-2-yl)methyl]amino]butanoic 4-[isopropyl-[(1-methylimidazol-…
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) | 0.36 | 6.28 | -56.79 | 1 | 5 | 0 | 62 | 239.319 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.36 | 5.99 | -48.36 | 0 | 5 | -1 | 61 | 238.311 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.36 | 8.29 | -102.42 | 2 | 5 | 1 | 64 | 240.327 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.36 | 8.11 | -53.57 | 1 | 5 | 0 | 62 | 239.319 | 7 | ↓ |