In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 19 | Yes |
Popular Name: (1S)-N-[[(1S)-cyclohex-3-en-1-yl]methyl]-1-cyclopentyl-1-(2-thienyl)methanamine (1S)-N-[[(1S)-cyclohex-3-en-1-yl…
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) | 5.16 | 10.67 | -38.03 | 2 | 1 | 1 | 17 | 276.469 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.16 | 9.46 | -1.36 | 1 | 1 | 0 | 12 | 275.461 | 5 | ↓ |