In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 15 | Yes |
Popular Name: (2R)-2-cyclopropyl-N1-methyl-N1-(thiazol-4-ylmethyl)propane-1,2-diamine (2R)-2-cyclopropyl-N1-methyl-N1-…
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) | 1.63 | 2.57 | -43.19 | 3 | 3 | 1 | 44 | 226.369 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 4.2 | -111.33 | 4 | 3 | 2 | 45 | 227.377 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 4.71 | -29.91 | 3 | 3 | 1 | 43 | 226.369 | 5 | ↓ |