In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2006 | 18 | Yes |
Popular Name: (4-isopropyl-1-methyl-5-phenylsulfanyl-imidazol-2-yl)methanamine (4-isopropyl-1-methyl-5-phenylsu…
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) | 2.82 | 6.74 | -50.3 | 3 | 3 | 1 | 45 | 262.402 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.82 | 6.35 | -7.38 | 2 | 3 | 0 | 44 | 261.394 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 6.8 | -25.67 | 3 | 3 | 1 | 45 | 262.402 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 7.19 | -116.42 | 4 | 3 | 2 | 47 | 263.41 | 4 | ↓ |