In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 15 | Yes |
Popular Name: (2R)-2-cyclopropyl-N2-methyl-N2-(thiazol-4-ylmethyl)propane-1,2-diamine (2R)-2-cyclopropyl-N2-methyl-N2-…
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) | 1.02 | 2.19 | -43.4 | 3 | 3 | 1 | 44 | 226.369 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.02 | 4.12 | -29.1 | 3 | 3 | 1 | 43 | 226.369 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.02 | 4.02 | -115.05 | 4 | 3 | 2 | 45 | 227.377 | 5 | ↓ |