In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2011 | 14 | Yes |
Popular Name: N-cyclopropyl-N-methyl-N'-(thiazol-4-ylmethyl)ethane-1,2-diamine N-cyclopropyl-N-methyl-N'-(thiaz…
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) | 1.06 | 3.61 | -32.93 | 2 | 3 | 1 | 29 | 212.342 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.06 | 1.16 | -4.06 | 1 | 3 | 0 | 28 | 211.334 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.06 | 2.53 | -38.33 | 2 | 3 | 1 | 33 | 212.342 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.06 | 4.97 | -108.52 | 3 | 3 | 2 | 34 | 213.35 | 6 | ↓ |