In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 21 | Yes |
Popular Name: (1S)-N'-cyclopentyl-N'-methyl-N-propyl-1-(p-tolyl)propane-1,3-diamine (1S)-N'-cyclopentyl-N'-methyl-N-…
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) | 3.81 | 10.89 | -36.32 | 2 | 2 | 1 | 16 | 289.487 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.81 | 11.9 | -113.57 | 3 | 2 | 2 | 21 | 290.495 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.