In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 15 | Yes |
Popular Name: N'-(cyclopropylmethyl)-N-methyl-N-(thiazol-4-ylmethyl)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) | 1.22 | 3.72 | -40.77 | 2 | 3 | 1 | 33 | 226.369 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.22 | 2.36 | -3.88 | 1 | 3 | 0 | 28 | 225.361 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.22 | 6.07 | -114.68 | 3 | 3 | 2 | 34 | 227.377 | 7 | ↓ |