In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 15 | Yes |
Popular Name: (3S)-3-[methyl-[(2-methylthiazol-4-yl)methyl]amino]butanamidine (3S)-3-[methyl-[(2-methylthiazol…
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) | 0.32 | 0.73 | -31.53 | 4 | 4 | 1 | 68 | 227.357 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.32 | 2.82 | -98.55 | 5 | 4 | 2 | 69 | 228.365 | 5 | ↓ |