In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 16 | No |
Popular Name: (1R,2S)-N-[(2-chloro-5-nitro-phenyl)methyl]-2-methyl-cyclopropanamine (1R,2S)-N-[(2-chloro-5-nitro-phe…
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) | 3.04 | 8.08 | -41.2 | 2 | 4 | 1 | 62 | 241.698 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.04 | 6.8 | -4.48 | 1 | 4 | 0 | 58 | 240.69 | 4 | ↓ |