In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2008 | 29 | Yes |
Popular Name: amino-ethyl-N-[4-(trifluoromethyl)phenyl]BLAHcarboxamide amino-ethyl-N-[4-(trifluoromethy…
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) | 4.05 | 5.59 | -10.25 | 3 | 5 | 0 | 71 | 420.46 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.05 | 5.95 | -38.11 | 4 | 5 | 1 | 72 | 421.468 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.05 | -1.19 | -111.89 | 5 | 5 | 2 | 74 | 422.476 | 4 | ↓ |