In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 20 | No |
Popular Name: (1S)-1-(benzothiophen-3-yl)-N-methyl-1-(5-nitro-2-furyl)methanamine (1S)-1-(benzothiophen-3-yl)-N-me…
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) | 3.51 | 8.11 | -52.23 | 2 | 5 | 1 | 76 | 289.336 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.51 | 7.04 | -10.55 | 1 | 5 | 0 | 71 | 288.328 | 4 | ↓ |