In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 16 | Yes |
Popular Name: N'-(cyclopropylmethyl)-N-methyl-N-[(2-methylthiazol-4-yl)methyl]ethane-1,2-diamine N'-(cyclopropylmethyl)-N-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) | 0.93 | 4.15 | -40.12 | 2 | 3 | 1 | 33 | 240.396 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.93 | 2.78 | -4.6 | 1 | 3 | 0 | 28 | 239.388 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.93 | 6.47 | -113.7 | 3 | 3 | 2 | 34 | 241.404 | 7 | ↓ |