In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 19 | Yes |
Popular Name: (1S)-N'-cyclopentyl-N'-ethyl-N-methyl-1-phenyl-propane-1,3-diamine (1S)-N'-cyclopentyl-N'-ethyl-N-m…
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) | 2.85 | 8.87 | -31.69 | 2 | 2 | 1 | 16 | 261.433 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.85 | 10.01 | -110.87 | 3 | 2 | 2 | 21 | 262.441 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.