In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (1S)-N-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)phenyl]ethane-1,2-diamine (1S)-N-cyclopentyl-N-methyl-1-[2…
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) | 2.98 | 6.12 | -40.55 | 3 | 2 | 1 | 31 | 287.349 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.98 | 7.13 | -124.3 | 4 | 2 | 2 | 32 | 288.357 | 5 | ↓ |