In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 17 | No |
Popular Name: N-[(2-aminothiazol-4-yl)methyl]-N-isobutyl-N',N'-dimethyl-ethane-1,2-diamine N-[(2-aminothiazol-4-yl)methyl]-…
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) | 1.67 | 4.89 | -36.29 | 3 | 4 | 1 | 47 | 257.427 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.67 | 1.96 | -4.76 | 2 | 4 | 0 | 45 | 256.419 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.67 | 5.59 | -78.4 | 4 | 4 | 2 | 48 | 258.435 | 7 | ↓ |